chempirical

3-Aminocyclopentanecarboxylic acid

C6H11NO2CAS 89614-96-0129.16 g/mol

Open in Covalent MOL file
OHONH2
Carboxylic acidPrimary amine

Properties

Molecular formula
C6H11NO2
Molar mass
129.16 g/mol
Exact mass
129.0790 Da
logP
0.20Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
89614-96-0
SMILES
C1CC(CC1C(=O)O)N
InChIKey
MLLSSTJTARJLHK-UHFFFAOYSA-N
InChI
InChI=1S/C6H11NO2/c7-5-2-1-4(3-5)6(8)9/h4-5H,1-3,7H2,(H,8,9)

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 3-Aminocyclopentanecarboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(1S,3R)-3-Aminocyclopentanecarboxylic acid71830-07-4Defined stereoisomer (1R,3S)-3-Aminocyclopentanecarboxylic acid71830-08-5Defined stereoisomer

Similar compounds

3-Aminocyclohexanecarboxylic acid25912-50-978 % similar rac-(1R,3S)-3-Aminocyclohexane-1-carboxylic acid81131-40-078 % similar 4-Aminocyclohexanecarboxylic acid1776-53-076 % similar cis-4-Aminocyclohexanecarboxylic acid3685-23-276 % similar trans-4-Aminocyclohexanecarboxylic acid3685-25-476 % similar 3-Aminocyclobutane-1-carboxylic acid74316-27-172 % similar trans-4-Amino-cyclohexane carboxylic acid hydrochloride27960-59-468 % similar 1,3-Cyclopentanedicarboxylic acid4056-78-467 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

L-Cyclopropylalanine102735-53-5 D-Cyclopropylalanine121786-39-8 4,4-Dimethoxybutanenitrile14618-78-1 N-Acetylmorpholine1696-20-4 (4S)-(-)-4-Isopropyl-2-oxazolidinone17016-83-0 (+)-Pipecolic acid1723-00-8 Dimethylacetoacetamide2044-64-6 (-)-Nipecotic acid25137-00-2

Elsewhere

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