3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid

C12H20N2O3 — CID 103550534

IUPAC3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
SMILESNC1CCCN(C(=O)C2CCC(C(=O)O)C2)C1
InChIInChI=1S/C12H20N2O3/c13-10-2-1-5-14(7-10)11(15)8-3-4-9(6-8)12(16)17/h8-10H,1-7,13H2,(H,16,17)
InChIKeyJJDOSEHUFUDHNO-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.44
Rot. Bonds2

About 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid

3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid (PubChem CID 103550534) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
PubChem CID103550534
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
SMILESNC1CCCN(C(=O)C2CCC(C(=O)O)C2)C1
InChIInChI=1S/C12H20N2O3/c13-10-2-1-5-14(7-10)11(15)8-3-4-9(6-8)12(16)17/h8-10H,1-7,13H2,(H,16,17)
InChIKeyJJDOSEHUFUDHNO-UHFFFAOYSA-N
XLogP0.44
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cis-(1S,3R)-3-(3-ethylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 114091790
(3-aminopiperidin-1-yl)-(4-methylcyclohexyl)methanone
CID 81458507
(3-aminopiperidin-1-yl)-(4-hydroxycyclohexyl)methanone
CID 112531005
3-(3-methylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63790111
cis-(1R,3S)-3-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 139534269
3-[3-(methylcarbamoyl)piperidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 103551311
3-(3-ethoxycarbonylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103549686
(3-aminopiperidin-1-yl)-(1-methylpiperidin-3-yl)methanone
CID 121200535
3-(4-methylazepane-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103550750
[(3R)-3-aminopiperidin-1-yl]-cyclohex-3-en-1-ylmethanone
CID 102983809
cis-(1S,3R)-3-[3-(methoxymethyl)pyrrolidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 114092440
3-(3,4-dimethylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103551239

Frequently Asked Questions

What is the IUPAC name of 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid?
The IUPAC name of 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid (CID 103550534) is 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid is NC1CCCN(C(=O)C2CCC(C(=O)O)C2)C1.
What is the InChIKey of 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid?
The InChIKey is JJDOSEHUFUDHNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c13-10-2-1-5-14(7-10)11(15)8-3-4-9(6-8)12(16)17/h8-10H,1-7,13H2,(H,16,17).
What are the key properties of 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid?
3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid has a molecular weight of 240.30 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-aminopiperidine-1-carbonyl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103550534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).