Chembase list of 866358 unique molecular structures

(2S,5S)-2,5-dimethylpiperazine dihydrochloride

$$$$

M. F.

C6H16Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14836

Database

Data ID

M. W.

187.11064

CAS

325148-85-4

Similarity

N/A

ID: 799802

(2S,5S)-2,5-bis(propan-2-yl)piperazine dihydrochloride

$$$$

M. F.

C10H24Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14837

Database

Data ID

M. W.

243.21696

CAS

Similarity

N/A

ID: 799803

(2S,5S)-2,5-bis(2-methylpropyl)piperazine dihydrochloride

$$$$

M. F.

C12H28Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14838

Database

Data ID

M. W.

271.27012

CAS

Similarity

N/A

ID: 799804

(2S,5S)-2,5-dibenzylpiperazine dihydrochloride

$$$$

M. F.

C18H24Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14839

Database

Data ID

M. W.

339.30256

CAS

Similarity

N/A

ID: 799805

(5S)-5-(hydroxymethyl)pyrrolidin-2-one

$$$$

M. F.

C5H9NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14840

Database

Data ID

M. W.

115.13046

CAS

17342-08-4

Similarity

N/A

ID: 799806

(5S)-5-(aminomethyl)pyrrolidin-2-one

$$$$

M. F.

C5H10N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14842

Database

Data ID

M. W.

114.1457

CAS

145414-31-9

Similarity

N/A

ID: 799807

tert-butyl (2S)-2-methylpiperazine-1-carboxylate

$$$$

M. F.

C10H20N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14844

Database

Data ID

M. W.

200.278

CAS

169447-70-5

Similarity

N/A

ID: 799808

CAS_126458-15-9,475640-803 molecular structure

(2S)-2-methylpiperazine dihydrochloride

$$$$

M. F.

C5H14Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14846 AJA-O37889

Database

Data ID

M. W.

173.08406

CAS

126458-15-9,475640-803

Similarity

N/A

ID: 799809

(2S)-1-benzyl-2-(propan-2-yl)piperazine

$$$$

M. F.

C14H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14847

Database

Data ID

M. W.

218.33788

CAS

220663-44-5

Similarity

N/A

ID: 799810

tert-butyl (3S)-3-(propan-2-yl)piperazine-1-carboxylate

$$$$

M. F.

C12H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14849

Database

Data ID

M. W.

228.33116

CAS

475272-54-9

Similarity

N/A

ID: 799811

(2S)-1-benzyl-2-(2-methylpropyl)piperazine

$$$$

M. F.

C15H24N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14851

Database

Data ID

M. W.

232.36446

CAS

78551-90-3

Similarity

N/A

ID: 799812

tert-butyl (3S)-3-(2-methylpropyl)piperazine-1-carboxylate

$$$$

M. F.

C13H26N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14853

Database

Data ID

M. W.

242.35774

CAS

928025-62-1

Similarity

N/A

ID: 799813

(2S)-2-(2-methylpropyl)piperazine dihydrochloride

$$$$

M. F.

C8H20Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14854

Database

Data ID

M. W.

215.1638

CAS

Similarity

N/A

ID: 799814

(2S)-1,2-dibenzylpiperazine

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14855

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 799815

tert-butyl (2S)-2-benzylpiperazine-1-carboxylate

$$$$

M. F.

C16H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14856

Database

Data ID

M. W.

276.37396

CAS

169447-86-3

Similarity

N/A

ID: 799816

tert-butyl (3S)-3-benzylpiperazine-1-carboxylate

$$$$

M. F.

C16H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14857

Database

Data ID

M. W.

276.37396

CAS

475272-55-0

Similarity

N/A

ID: 799817

(2S)-2-benzylpiperazine dihydrochloride

$$$$

M. F.

C11H18Cl2N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14858

Database

Data ID

M. W.

249.18002

CAS

133525-05-0

Similarity

N/A

ID: 799818

[(2R)-1-benzylpiperazin-2-yl]methanol

$$$$

M. F.

C12H18N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14859

Database

Data ID

M. W.

206.28412

CAS

Similarity

N/A

ID: 799819

tert-butyl (3R)-3-(hydroxymethyl)piperazine-1-carboxylate

$$$$

M. F.

C10H20N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14861 AJA-O17166

Database

Data ID

M. W.

216.2774

CAS

278788-66-2

Similarity

N/A

ID: 799820

[(2R)-piperazin-2-yl]methanol dihydrochloride

$$$$

M. F.

C5H14Cl2N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14862

Database

Data ID

M. W.

189.08346

CAS

Similarity

N/A

ID: 799821

(2R)-1-benzylpiperazine-2-carboxylic acid

$$$$

M. F.

C12H16N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14863

Database

Data ID

M. W.

220.26764

CAS

Similarity

N/A

ID: 799822

(2R)-1-[(tert-butoxy)carbonyl]piperazine-2-carboxylic acid

$$$$

M. F.

C10H18N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14864

Database

Data ID

M. W.

230.26092

CAS

278788-60-6

Similarity

N/A

ID: 799823

(2R)-4-[(tert-butoxy)carbonyl]piperazine-2-carboxylic acid

$$$$

M. F.

C10H18N2O4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O17057 AJA-O14865

Database

Data ID

M. W.

230.26092

CAS

192330-11-3

Similarity

N/A

ID: 799824

(2R)-piperazine-2-carboxylic acid dihydrochloride

$$$$

M. F.

C5H12Cl2N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14866

Database

Data ID

M. W.

203.06698

CAS

126330-90-3

Similarity

N/A

ID: 799825

methyl (2R)-1-benzylpiperazine-2-carboxylate

$$$$

M. F.

C13H18N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14867

Database

Data ID

M. W.

234.29422

CAS

Similarity

N/A

ID: 799826

methyl (2R)-piperazine-2-carboxylate dihydrochloride

$$$$

M. F.

C6H14Cl2N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14868

Database

Data ID

M. W.

217.09356

CAS

637027-25-9

Similarity

N/A

ID: 799827

5-fluoro-6-methoxy-1H-indole

$$$$

M. F.

C9H8FNO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14869

Database

Data ID

M. W.

165.1643232

CAS

1211595-72-0

Similarity

N/A

ID: 799828

5-fluoro-6-methoxy-1H-indole-3-carbonitrile

$$$$

M. F.

C10H7FN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14870

Database

Data ID

M. W.

190.1737832

CAS

1211593-82-6

Similarity

N/A

ID: 799829

6-methoxy-1H-indole-3-carbonitrile

$$$$

M. F.

C10H8N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14871

Database

Data ID

M. W.

172.18332

CAS

145692-57-5

Similarity

N/A

ID: 799830

6-(difluoromethoxy)-1H-indole

$$$$

M. F.

C9H7F2NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14872

Database

Data ID

M. W.

183.1547864

CAS

200207-21-2

Similarity

N/A

ID: 799831

6-(difluoromethoxy)-1H-indole-3-carbonitrile

$$$$

M. F.

C10H6F2N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14873

Database

Data ID

M. W.

208.1642464

CAS

Similarity

N/A

ID: 799832

6-(trifluoromethoxy)-1H-indole-3-carbonitrile

$$$$

M. F.

C10H5F3N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14875

Database

Data ID

M. W.

226.1547096

CAS

Similarity

N/A

ID: 799833

6-bromo-5-fluoro-1H-indole-3-carbonitrile

$$$$

M. F.

C9H4BrFN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14877

Database

Data ID

M. W.

239.0438632

CAS

Similarity

N/A

ID: 799834

methyl[1-(4-phenylphenyl)-2-(pyrrolidin-1-yl)ethyl]amine

$$$$

M. F.

C19H24N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14878

Database

Data ID

M. W.

280.40726

CAS

Similarity

N/A

ID: 799835

[1-(1H-indol-3-yl)-2-(pyrrolidin-1-yl)ethyl](methyl)amine

$$$$

M. F.

C15H21N3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14879

Database

Data ID

M. W.

243.34734

CAS

Similarity

N/A

ID: 799836

[1-(4-chlorophenyl)-2-(pyrrolidin-1-yl)ethyl](methyl)amine

$$$$

M. F.

C13H19ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14880

Database

Data ID

M. W.

238.75636

CAS

Similarity

N/A

ID: 799837

[1-(3-chlorophenyl)-3-(pyrrolidin-1-yl)propyl](methyl)amine

$$$$

M. F.

C14H21ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14881

Database

Data ID

M. W.

252.78294

CAS

Similarity

N/A

ID: 799838

[1-(4-chlorophenyl)-3-(pyrrolidin-1-yl)propyl](methyl)amine

$$$$

M. F.

C14H21ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14882

Database

Data ID

M. W.

252.78294

CAS

Similarity

N/A

ID: 799839

benzyl N-[1-(4-chlorophenyl)-2-(pyrrolidin-1-yl)ethyl]-N-methylcarbamate

$$$$

M. F.

C21H25ClN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14883

Database

Data ID

M. W.

372.8884

CAS

Similarity

N/A

ID: 799840

[1-(2-chlorophenyl)-3-(pyrrolidin-1-yl)propyl](methyl)amine

$$$$

M. F.

C14H21ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14884

Database

Data ID

M. W.

252.78294

CAS

Similarity

N/A

ID: 799841

benzyl N-[1-(2-chlorophenyl)-2-(pyrrolidin-1-yl)ethyl]-N-methylcarbamate

$$$$

M. F.

C21H25ClN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14885

Database

Data ID

M. W.

372.8884

CAS

Similarity

N/A

ID: 799842

N-methyl-2-[(pyrrolidin-1-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine

$$$$

M. F.

C16H24N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14886

Database

Data ID

M. W.

244.37516

CAS

Similarity

N/A

ID: 799843

[1-cyclohexyl-2-(pyrrolidin-1-yl)ethyl](methyl)amine

$$$$

M. F.

C13H26N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14887

Database

Data ID

M. W.

210.35894

CAS

Similarity

N/A

ID: 799844

[3,3-dimethyl-1-(pyrrolidin-1-yl)butan-2-yl](methyl)amine

$$$$

M. F.

C11H24N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14888

Database

Data ID

M. W.

184.32166

CAS

Similarity

N/A

ID: 799845

(2S)-2-amino-1-(3-hydroxypyrrolidin-1-yl)-2-phenylethan-1-one

$$$$

M. F.

C12H16N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14889

Database

Data ID

M. W.

220.26764

CAS

Similarity

N/A

ID: 799846

(3S)-1-[2-(4-fluorophenyl)-2-(methylamino)ethyl]pyrrolidin-3-ol dihydrochloride

$$$$

M. F.

C13H21Cl2FN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14890

Database

Data ID

M. W.

311.2230432

CAS

Similarity

N/A

ID: 799847

(3S)-1-[3-methyl-2-(methylamino)butyl]pyrrolidin-3-ol dihydrochloride

$$$$

M. F.

C10H24Cl2N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31852 AJA-O14891

Database

Data ID

M. W.

259.21636

CAS

193693-68-4

Similarity

N/A

ID: 799848

(3S)-1-[2-(methylamino)-2-phenylethyl]pyrrolidin-3-ol

$$$$

M. F.

C13H20N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14892

Database

Data ID

M. W.

220.3107

CAS

Similarity

N/A

ID: 799849

3-amino-3-(2-chlorophenyl)-1-(pyrrolidin-1-yl)propan-1-one

$$$$

M. F.

C13H17ClN2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14893

Database

Data ID

M. W.

252.73988

CAS

Similarity

N/A

ID: 799850

N-methyl-4-[(pyrrolidin-1-yl)methyl]oxan-4-amine

$$$$

M. F.

C11H22N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O14894

Database

Data ID

M. W.

198.30518

CAS

885951-12-2

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified