2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid

C15H18N2O4 — CID 103977919

IUPAC2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid
SMILESCNC(=O)c1ccccc1NC(=O)C1CCCC1C(=O)O
InChIInChI=1S/C15H18N2O4/c1-16-13(18)11-5-2-3-8-12(11)17-14(19)9-6-4-7-10(9)15(20)21/h2-3,5,8-10H,4,6-7H2,1H3,(H,16,18)(H,17,19)(H,20,21)
InChIKeyLFCGSIOTLANKPC-UHFFFAOYSA-N
MW290.32 g/mol
LogP1.49
Rot. Bonds4

About 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid

2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid (PubChem CID 103977919) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid
PubChem CID103977919
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid
SMILESCNC(=O)c1ccccc1NC(=O)C1CCCC1C(=O)O
InChIInChI=1S/C15H18N2O4/c1-16-13(18)11-5-2-3-8-12(11)17-14(19)9-6-4-7-10(9)15(20)21/h2-3,5,8-10H,4,6-7H2,1H3,(H,16,18)(H,17,19)(H,20,21)
InChIKeyLFCGSIOTLANKPC-UHFFFAOYSA-N
XLogP1.49
TPSA95.50 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(1S,6S)-6-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 8893563
N-methyl-2-[(2-phenylcyclopropanecarbonyl)amino]benzamide
CID 110606701
trans-(1R,2R)-2-[[2-[(2-methoxyphenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 982063
2-[[2-[(4-propan-2-ylphenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 11842149
cis-(1R,2S)-2-[[2-[(4-methoxyphenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 982067
cis-(1R,2S)-2-[[2-[(3-chlorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 982056
2-[[2-[(2,4-difluorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 56696815
cis-(1S,2R)-2-[[2-[(2,4-difluorophenyl)carbamoyl]phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 981866
2-[(2-aminophenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 61403717
trans-(1S,2S)-2-[(2-chlorophenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 786077
2-[(2-tert-butylphenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 22688945
N-[2-(methylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 18071955

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid (CID 103977919) is 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid is CNC(=O)c1ccccc1NC(=O)C1CCCC1C(=O)O.
What is the InChIKey of 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid?
The InChIKey is LFCGSIOTLANKPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-16-13(18)11-5-2-3-8-12(11)17-14(19)9-6-4-7-10(9)15(20)21/h2-3,5,8-10H,4,6-7H2,1H3,(H,16,18)(H,17,19)(H,20,21).
What are the key properties of 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid?
2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid has a molecular weight of 290.32 g/mol, XLogP of 1.49, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(methylcarbamoyl)phenyl]carbamoyl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 103977919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).