2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid

C16H18N2O3 — CID 63748053

IUPAC2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)c1ccc2[nH]ccc2c1)C1CCCC1
InChIInChI=1S/C16H18N2O3/c19-15(20)10-18(13-3-1-2-4-13)16(21)12-5-6-14-11(9-12)7-8-17-14/h5-9,13,17H,1-4,10H2,(H,19,20)
InChIKeyJVDDODOEWHCIDM-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.64
Rot. Bonds4

About 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid

2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid (PubChem CID 63748053) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid
PubChem CID63748053
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid
SMILESO=C(O)CN(C(=O)c1ccc2[nH]ccc2c1)C1CCCC1
InChIInChI=1S/C16H18N2O3/c19-15(20)10-18(13-3-1-2-4-13)16(21)12-5-6-14-11(9-12)7-8-17-14/h5-9,13,17H,1-4,10H2,(H,19,20)
InChIKeyJVDDODOEWHCIDM-UHFFFAOYSA-N
XLogP2.64
TPSA73.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic 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

N-cyclopentyl-N-(2-hydroxyethyl)-1H-indole-5-carboxamide
CID 63748789
N-cyclopentyl-N-prop-2-enyl-1H-indole-5-carboxamide
CID 63717710
N-(2-amino-2-oxoethyl)-N-cyclopentyl-1H-indole-6-carboxamide
CID 61217148
methyl 2-[cyclopentyl(1H-indole-6-carbonyl)amino]acetate
CID 75381587
2-[(3-chloro-4-hydroxybenzoyl)-cyclopentylamino]acetic acid
CID 60826765
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-1H-indole-5-carboxamide
CID 63719157
N-cyclopentyl-N-(furan-2-ylmethyl)-1H-indole-6-carboxamide
CID 56797541
3-(1H-indol-5-yl)-3-oxopropanoic acid
CID 170886874
2-[cyclopropyl-(3,4-dichlorobenzoyl)amino]acetic acid
CID 54946136
N-(2,2-dimethyloxan-4-yl)-N-ethyl-1H-indole-5-carboxamide
CID 126810790
2-[(4-cyclopentyloxy-3-methoxybenzoyl)-(oxan-4-yl)amino]acetic acid
CID 126775681
N-cyclohexyl-N-[2-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]-2-oxoethyl]-1H-indole-6-carboxamide;dihydrochloride
CID 22321771

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid (CID 63748053) is 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid is O=C(O)CN(C(=O)c1ccc2[nH]ccc2c1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid?
The InChIKey is JVDDODOEWHCIDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c19-15(20)10-18(13-3-1-2-4-13)16(21)12-5-6-14-11(9-12)7-8-17-14/h5-9,13,17H,1-4,10H2,(H,19,20).
What are the key properties of 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid?
2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid has a molecular weight of 286.33 g/mol, XLogP of 2.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(1H-indole-5-carbonyl)amino]acetic acid is sourced from PubChem (CID 63748053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).