Chembase list of 866358 unique molecular structures

$$$$

M. F.

C6H14N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23407

Database

Data ID

M. W.

114.18876

CAS

Similarity

N/A

ID: 806102

(2R,5R)-2,5-dimethylpiperazine

$$$$

M. F.

C6H14N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23408

Database

Data ID

M. W.

114.18876

CAS

Similarity

N/A

ID: 806103

(2R,5S)-2,5-diethylpiperazine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23409

Database

Data ID

M. W.

142.24192

CAS

6189-24-8

Similarity

N/A

ID: 806104

(2S,5S)-2,5-diethylpiperazine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23410

Database

Data ID

M. W.

142.24192

CAS

1240590-22-0

Similarity

N/A

ID: 806105

(2R,5R)-2,5-diethylpiperazine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23411

Database

Data ID

M. W.

142.24192

CAS

59573-45-4

Similarity

N/A

ID: 806106

rel-(2R,5S)-2,5-bis(propan-2-yl)piperazine

$$$$

M. F.

C10H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23412

Database

Data ID

M. W.

170.29508

CAS

114420-45-0

Similarity

N/A

ID: 806107

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

$$$$

M. F.

C10H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23413

Database

Data ID

M. W.

170.29508

CAS

114409-91-5

Similarity

N/A

ID: 806108

(2R,5R)-2,5-bis(propan-2-yl)piperazine

$$$$

M. F.

C10H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23414

Database

Data ID

M. W.

170.29508

CAS

114420-44-9

Similarity

N/A

ID: 806109

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

$$$$

M. F.

C12H26N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23415

Database

Data ID

M. W.

198.34824

CAS

114362-34-4

Similarity

N/A

ID: 806110

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

$$$$

M. F.

C12H26N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23416

Database

Data ID

M. W.

198.34824

CAS

138812-51-8

Similarity

N/A

ID: 806111

(2R,5R)-2,5-bis(2-methylpropyl)piperazine

$$$$

M. F.

C12H26N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23417

Database

Data ID

M. W.

198.34824

CAS

114362-33-3

Similarity

N/A

ID: 806112

(2R,5S)-2,5-bis(2,2,2-trifluoroethyl)piperazine

$$$$

M. F.

C8H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23418

Database

Data ID

M. W.

250.1846992

CAS

Similarity

N/A

ID: 806113

(2S,5S)-2,5-bis(2,2,2-trifluoroethyl)piperazine

$$$$

M. F.

C8H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23419

Database

Data ID

M. W.

250.1846992

CAS

Similarity

N/A

ID: 806114

(2R,5R)-2,5-bis(2,2,2-trifluoroethyl)piperazine

$$$$

M. F.

C8H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23420

Database

Data ID

M. W.

250.1846992

CAS

Similarity

N/A

ID: 806115

(2R,5S)-2,5-diphenylpiperazine

$$$$

M. F.

C16H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23421

Database

Data ID

M. W.

238.32752

CAS

Similarity

N/A

ID: 806116

(2S,5S)-2,5-diphenylpiperazine

$$$$

M. F.

C16H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23422

Database

Data ID

M. W.

238.32752

CAS

Similarity

N/A

ID: 806117

(2R,5R)-2,5-diphenylpiperazine

$$$$

M. F.

C16H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23423

Database

Data ID

M. W.

238.32752

CAS

Similarity

N/A

ID: 806118

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

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23424

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 806119

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

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23425

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 806120

(2R,5R)-2,5-dibenzylpiperazine

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23426

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 806121

(2S,6S)-2,6-dimethylpiperazine

$$$$

M. F.

C6H14N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23427

Database

Data ID

M. W.

114.18876

CAS

402832-69-3

Similarity

N/A

ID: 806122

(2R,6R)-2,6-dimethylpiperazine

$$$$

M. F.

C6H14N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23428

Database

Data ID

M. W.

114.18876

CAS

162240-93-9

Similarity

N/A

ID: 806123

(2S,6S)-2,6-diethylpiperazine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23429

Database

Data ID

M. W.

142.24192

CAS

1240583-50-9

Similarity

N/A

ID: 806124

(2R,6R)-2,6-diethylpiperazine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23430

Database

Data ID

M. W.

142.24192

CAS

Similarity

N/A

ID: 806125

(2R,6S)-2,6-diethylpiperazine

$$$$

M. F.

C8H18N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23431

Database

Data ID

M. W.

142.24192

CAS

1240618-27-2

Similarity

N/A

ID: 806126

(2S,6S)-2,6-bis(2,2,2-trifluoroethyl)piperazine

$$$$

M. F.

C8H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23432

Database

Data ID

M. W.

250.1846992

CAS

Similarity

N/A

ID: 806127

(2R,6R)-2,6-bis(2,2,2-trifluoroethyl)piperazine

$$$$

M. F.

C8H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23433

Database

Data ID

M. W.

250.1846992

CAS

Similarity

N/A

ID: 806128

(2R,6S)-2,6-bis(2,2,2-trifluoroethyl)piperazine

$$$$

M. F.

C8H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23434

Database

Data ID

M. W.

250.1846992

CAS

Similarity

N/A

ID: 806129

(2S,6S)-2,6-dibenzylpiperazine

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23435

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 806130

(2R,6R)-2,6-dibenzylpiperazine

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23436

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 806131

(2R,6S)-2,6-dibenzylpiperazine

$$$$

M. F.

C18H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23437

Database

Data ID

M. W.

266.38068

CAS

Similarity

N/A

ID: 806132

(3R,4R)-pyrrolidine-3,4-diol

$$$$

M. F.

C4H9NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23438

Database

Data ID

M. W.

103.11976

CAS

1104000-68-1

Similarity

N/A

ID: 806133

(3S,4S)-pyrrolidine-3,4-diol

$$$$

M. F.

C4H9NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23439

Database

Data ID

M. W.

103.11976

CAS

9046-10-0

Similarity

N/A

ID: 806134

(3R,4R)-1-(2-aminoethyl)pyrrolidine-3,4-diol

$$$$

M. F.

C6H14N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23440

Database

Data ID

M. W.

146.18756

CAS

Similarity

N/A

ID: 806135

(3R,4R)-1-(3-aminopropyl)pyrrolidine-3,4-diol

$$$$

M. F.

C7H16N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23441

Database

Data ID

M. W.

160.21414

CAS

Similarity

N/A

ID: 806136

(3S,4S)-1-(2-aminoethyl)pyrrolidine-3,4-diol

$$$$

M. F.

C6H14N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23442

Database

Data ID

M. W.

146.18756

CAS

Similarity

N/A

ID: 806137

(3S,4S)-1-(3-aminopropyl)pyrrolidine-3,4-diol

$$$$

M. F.

C7H16N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23443

Database

Data ID

M. W.

160.21414

CAS

Similarity

N/A

ID: 806138

2-[3,5-bis(trifluoromethyl)phenyl]piperazine

$$$$

M. F.

C12H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23444

Database

Data ID

M. W.

298.2274992

CAS

Similarity

N/A

ID: 806139

(2S)-2-[3,5-bis(trifluoromethyl)phenyl]piperazine

$$$$

M. F.

C12H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23445

Database

Data ID

M. W.

298.2274992

CAS

Similarity

N/A

ID: 806140

(2R)-2-[3,5-bis(trifluoromethyl)phenyl]piperazine

$$$$

M. F.

C12H12F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23446

Database

Data ID

M. W.

298.2274992

CAS

Similarity

N/A

ID: 806141

2-{[3,5-bis(trifluoromethyl)phenyl]methyl}piperazine

$$$$

M. F.

C13H14F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23447

Database

Data ID

M. W.

312.2540792

CAS

Similarity

N/A

ID: 806142

(2S)-2-{[3,5-bis(trifluoromethyl)phenyl]methyl}piperazine

$$$$

M. F.

C13H14F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23448

Database

Data ID

M. W.

312.2540792

CAS

Similarity

N/A

ID: 806143

(2R)-2-{[3,5-bis(trifluoromethyl)phenyl]methyl}piperazine

$$$$

M. F.

C13H14F6N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23449

Database

Data ID

M. W.

312.2540792

CAS

Similarity

N/A

ID: 806144

tert-butyl 3-[3,5-bis(trifluoromethyl)phenyl]piperazine-1-carboxylate

$$$$

M. F.

C17H20F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23450

Database

Data ID

M. W.

398.3433192

CAS

Similarity

N/A

ID: 806145

tert-butyl (3S)-3-[3,5-bis(trifluoromethyl)phenyl]piperazine-1-carboxylate

$$$$

M. F.

C17H20F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23451

Database

Data ID

M. W.

398.3433192

CAS

Similarity

N/A

ID: 806146

tert-butyl (3R)-3-[3,5-bis(trifluoromethyl)phenyl]piperazine-1-carboxylate

$$$$

M. F.

C17H20F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23452

Database

Data ID

M. W.

398.3433192

CAS

Similarity

N/A

ID: 806147

tert-butyl 2-[3,5-bis(trifluoromethyl)phenyl]piperazine-1-carboxylate

$$$$

M. F.

C17H20F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23453

Database

Data ID

M. W.

398.3433192

CAS

Similarity

N/A

ID: 806148

tert-butyl (2S)-2-[3,5-bis(trifluoromethyl)phenyl]piperazine-1-carboxylate

$$$$

M. F.

C17H20F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23454

Database

Data ID

M. W.

398.3433192

CAS

Similarity

N/A

ID: 806149

tert-butyl (2R)-2-[3,5-bis(trifluoromethyl)phenyl]piperazine-1-carboxylate

$$$$

M. F.

C17H20F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23455

Database

Data ID

M. W.

398.3433192

CAS

Similarity

N/A

ID: 806150

tert-butyl 3-{[3,5-bis(trifluoromethyl)phenyl]methyl}piperazine-1-carboxylate

$$$$

M. F.

C18H22F6N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O23456

Database

Data ID

M. W.

412.3698992

CAS

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