2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid

C14H23NO3 — CID 103977670

IUPAC2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
SMILESCN(C(=O)C1CCCC1C(=O)O)C1CCCCC1
InChIInChI=1S/C14H23NO3/c1-15(10-6-3-2-4-7-10)13(16)11-8-5-9-12(11)14(17)18/h10-12H,2-9H2,1H3,(H,17,18)
InChIKeyQANDPSNULRDFBY-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.28
Rot. Bonds3

About 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid

2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid (PubChem CID 103977670) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
PubChem CID103977670
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid
SMILESCN(C(=O)C1CCCC1C(=O)O)C1CCCCC1
InChIInChI=1S/C14H23NO3/c1-15(10-6-3-2-4-7-10)13(16)11-8-5-9-12(11)14(17)18/h10-12H,2-9H2,1H3,(H,17,18)
InChIKeyQANDPSNULRDFBY-UHFFFAOYSA-N
XLogP2.28
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cyclohexyl(methyl)carbamoyl]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

2-[methyl-(4-methylcyclohexyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 43579803
2-[cyclobutyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 115730407
2-[methyl-(1-methylpiperidin-3-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978705
2-[cyclohexyl(ethyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 16792487
4-[cycloheptyl(methyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63784841
2-[(2-hydroxycyclohexyl)-methylcarbamoyl]cyclohexane-1-carboxylic acid
CID 102631714
cis-(1S,2R)-2-[cyclopropyl(methyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 93311623
2-[cyclohexyl(2-hydroxyethyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103978364
2-[[cyclopentyl(methyl)carbamoyl]amino]cyclohexane-1-carboxylic acid
CID 64816118
2-[di(propan-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 3791717
2-methylcyclooctane-1-carboxylic acid
CID 21039885
4-[cyclohexanecarbonyl(methyl)amino]cyclohexane-1-carboxylic acid
CID 115270026

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid (CID 103977670) is 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid is CN(C(=O)C1CCCC1C(=O)O)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
The InChIKey is QANDPSNULRDFBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-15(10-6-3-2-4-7-10)13(16)11-8-5-9-12(11)14(17)18/h10-12H,2-9H2,1H3,(H,17,18).
What are the key properties of 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid?
2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid has a molecular weight of 253.34 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(methyl)carbamoyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103977670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).