Chembase list of 866358 unique molecular structures

tert-butyl 5,8-diazaspiro[3.5]nonane-5-carboxylate

$$$$

M. F.

C12H22N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24701

Database

Data ID

M. W.

226.31528

CAS

886766-34-3

Similarity

N/A

ID: 806802

tert-butyl 6,9-diazaspiro[4.5]decane-9-carboxylate

$$$$

M. F.

C13H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24702

Database

Data ID

M. W.

240.34186

CAS

886766-37-6

Similarity

N/A

ID: 806803

tert-butyl 6,9-diazaspiro[4.5]decane-6-carboxylate

$$$$

M. F.

C13H24N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24703

Database

Data ID

M. W.

240.34186

CAS

Similarity

N/A

ID: 806804

1,2,3,4-tetrahydroquinolin-4-amine hydrochloride

$$$$

M. F.

C9H13ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24704

Database

Data ID

M. W.

184.66592

CAS

7578-79-2

Similarity

N/A

ID: 806805

1-cycloheptylpiperidin-4-one

$$$$

M. F.

C12H21NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24707

Database

Data ID

M. W.

195.30124

CAS

886365-24-8

Similarity

N/A

ID: 806806

1-(butan-2-yl)piperidin-4-one

$$$$

M. F.

C9H17NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24708

Database

Data ID

M. W.

155.23738

CAS

72544-17-3

Similarity

N/A

ID: 806807

1-(butan-2-yl)piperidin-3-one

$$$$

M. F.

C9H17NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24711

Database

Data ID

M. W.

155.23738

CAS

Similarity

N/A

ID: 806808

1-cyclopropylpiperidin-3-one

$$$$

M. F.

C8H13NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24712

Database

Data ID

M. W.

139.19492

CAS

886365-30-6

Similarity

N/A

ID: 806809

1-cyclohexylpiperidin-3-one

$$$$

M. F.

C11H19NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24714

Database

Data ID

M. W.

181.27466

CAS

Similarity

N/A

ID: 806810

1-cycloheptylpiperidin-3-one

$$$$

M. F.

C12H21NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24715

Database

Data ID

M. W.

195.30124

CAS

886365-39-5

Similarity

N/A

ID: 806811

1-cyclooctylpiperidin-3-one

$$$$

M. F.

C13H23NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24716

Database

Data ID

M. W.

209.32782

CAS

Similarity

N/A

ID: 806812

1-cyclooctylpiperidin-4-one

$$$$

M. F.

C13H23NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24717

Database

Data ID

M. W.

209.32782

CAS

Similarity

N/A

ID: 806813

1-benzyl 3-ethyl (3R)-piperidine-1,3-dicarboxylate

$$$$

M. F.

C16H21NO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24721

Database

Data ID

M. W.

291.34224

CAS

435275-85-7

Similarity

N/A

ID: 806814

1-benzyl 3-ethyl (3S)-piperidine-1,3-dicarboxylate

$$$$

M. F.

C16H21NO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24722

Database

Data ID

M. W.

291.34224

CAS

174699-11-7

Similarity

N/A

ID: 806815

(2S,4S)-4-fluoropyrrolidine-2-carbonitrile

$$$$

M. F.

C5H7FN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24723

Database

Data ID

M. W.

114.1208832

CAS

Similarity

N/A

ID: 806816

6-chloroisoquinolin-1-amine

$$$$

M. F.

C9H7ClN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24725

Database

Data ID

M. W.

178.61828

CAS

102200-00-0

Similarity

N/A

ID: 806817

(3S)-3-methyl-1,2,3,4-tetrahydroisoquinoline

$$$$

M. F.

C10H13N

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24726

Database

Data ID

M. W.

147.21692

CAS

Similarity

N/A

ID: 806818

6-bromo-3-methyl-1,2,3,4-tetrahydroisoquinoline

$$$$

M. F.

C10H12BrN

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24727

Database

Data ID

M. W.

226.11298

CAS

Similarity

N/A

ID: 806819

2-[(2R)-pyrrolidin-2-yl]pyridine

$$$$

M. F.

C9H12N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24728

Database

Data ID

M. W.

148.20498

CAS

Similarity

N/A

ID: 806820

5-bromo-2-(pyrrolidin-2-yl)pyridine

$$$$

M. F.

C9H11BrN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24729

Database

Data ID

M. W.

227.10104

CAS

886365-48-6

Similarity

N/A

ID: 806821

4-bromo-2-(pyrrolidin-2-yl)pyridine

$$$$

M. F.

C9H11BrN2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24730

Database

Data ID

M. W.

227.10104

CAS

886365-52-2

Similarity

N/A

ID: 806822

2-[(2S)-pyrrolidin-2-yl]pyridine

$$$$

M. F.

C9H12N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24731

Database

Data ID

M. W.

148.20498

CAS

Similarity

N/A

ID: 806823

2,3-dimethoxy-5-methylbenzaldehyde

$$$$

M. F.

C10H12O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24732

Database

Data ID

M. W.

180.20048

CAS

5701-86-0

Similarity

N/A

ID: 806824

1-(2-nitrophenyl)cyclopropane-1-carbonitrile

$$$$

M. F.

C10H8N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24734

Database

Data ID

M. W.

188.18272

CAS

147644-06-2

Similarity

N/A

ID: 806825

{1-[2-(trifluoromethyl)phenyl]cyclopropyl}methanamine

$$$$

M. F.

C11H12F3N

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24739

Database

Data ID

M. W.

215.2148896

CAS

Similarity

N/A

ID: 806826

[1-(4-nitrophenyl)cyclopropyl]methanamine

$$$$

M. F.

C10H12N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24741

Database

Data ID

M. W.

192.21448

CAS

561297-86-7

Similarity

N/A

ID: 806827

{1-[4-(trifluoromethyl)phenyl]cyclopropyl}methanamine

$$$$

M. F.

C11H12F3N

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24742

Database

Data ID

M. W.

215.2148896

CAS

Similarity

N/A

ID: 806828

[1-(3-methoxyphenyl)cyclopropyl]methanamine

$$$$

M. F.

C11H15NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24746

Database

Data ID

M. W.

177.2429

CAS

Similarity

N/A

ID: 806829

[1-(2-nitrophenyl)cyclopropyl]methanamine

$$$$

M. F.

C10H12N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24748

Database

Data ID

M. W.

192.21448

CAS

Similarity

N/A

ID: 806830

1-(2-nitrophenyl)cyclopropane-1-carboxylic acid

$$$$

M. F.

C10H9NO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24749

Database

Data ID

M. W.

207.18276

CAS

422280-53-3

Similarity

N/A

ID: 806831

[1-(2-bromophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11BrO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24750

Database

Data ID

M. W.

227.09774

CAS

886366-19-4

Similarity

N/A

ID: 806832

[1-(2-fluorophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11FO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24751

Database

Data ID

M. W.

166.1921432

CAS

886366-22-9

Similarity

N/A

ID: 806833

[1-(2-chlorophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11ClO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24752

Database

Data ID

M. W.

182.64674

CAS

886366-24-1

Similarity

N/A

ID: 806834

[1-(2-methoxyphenyl)cyclopropyl]methanol

$$$$

M. F.

C11H14O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24753

Database

Data ID

M. W.

178.22766

CAS

98480-36-5

Similarity

N/A

ID: 806835

{1-[2-(trifluoromethyl)phenyl]cyclopropyl}methanol

$$$$

M. F.

C11H11F3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24754

Database

Data ID

M. W.

216.1996496

CAS

886366-27-4

Similarity

N/A

ID: 806836

[1-(4-nitrophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24755

Database

Data ID

M. W.

193.19924

CAS

Similarity

N/A

ID: 806837

[1-(4-fluorophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11FO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24757

Database

Data ID

M. W.

166.1921432

CAS

198976-40-8

Similarity

N/A

ID: 806838

[1-(4-methoxyphenyl)cyclopropyl]methanol

$$$$

M. F.

C11H14O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24758

Database

Data ID

M. W.

178.22766

CAS

16728-03-3

Similarity

N/A

ID: 806839

{1-[4-(trifluoromethyl)phenyl]cyclopropyl}methanol

$$$$

M. F.

C11H11F3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24759

Database

Data ID

M. W.

216.1996496

CAS

850406-46-1

Similarity

N/A

ID: 806840

[1-(3-bromophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11BrO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24760

Database

Data ID

M. W.

227.09774

CAS

886366-33-2

Similarity

N/A

ID: 806841

[1-(3-chlorophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11ClO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24761

Database

Data ID

M. W.

182.64674

CAS

98480-33-2

Similarity

N/A

ID: 806842

[1-(3-fluorophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11FO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24762

Database

Data ID

M. W.

166.1921432

CAS

886366-36-5

Similarity

N/A

ID: 806843

[1-(3-methoxyphenyl)cyclopropyl]methanol

$$$$

M. F.

C11H14O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24763

Database

Data ID

M. W.

178.22766

CAS

886366-39-8

Similarity

N/A

ID: 806844

{1-[3-(trifluoromethyl)phenyl]cyclopropyl}methanol

$$$$

M. F.

C11H11F3O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24764

Database

Data ID

M. W.

216.1996496

CAS

886366-41-2

Similarity

N/A

ID: 806845

[1-(2-nitrophenyl)cyclopropyl]methanol

$$$$

M. F.

C10H11NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24765

Database

Data ID

M. W.

193.19924

CAS

Similarity

N/A

ID: 806846

1-(2-methoxyphenyl)cyclopropan-1-amine

$$$$

M. F.

C10H13NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24766

Database

Data ID

M. W.

163.21632

CAS

503417-32-1

Similarity

N/A

ID: 806847

1-(2-nitrophenyl)cyclopropan-1-amine

$$$$

M. F.

C9H10N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24768

Database

Data ID

M. W.

178.1879

CAS

886366-59-2

Similarity

N/A

ID: 806848

[5-(trifluoroacetyl)pyridin-3-yl]boronic acid

$$$$

M. F.

C7H5BF3NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24769

Database

Data ID

M. W.

218.9257096

CAS

Similarity

N/A

ID: 806849

1-(5-bromopyridin-3-yl)-2,2,2-trifluoroethan-1-one

$$$$

M. F.

C7H3BrF3NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24770

Database

Data ID

M. W.

254.0040296

CAS

886364-44-9

Similarity

N/A

ID: 806850

tert-butyl N-[1-(5-bromopyridin-3-yl)-2,2,2-trifluoroethyl]carbamate

$$$$

M. F.

C12H14BrF3N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O24771

Database

Data ID

M. W.

355.1509696

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