3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide

C20H21ClN2O3 — CID 55783455

IUPAC3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide
SMILESCOc1ccc(C(N)=O)cc1NC(=O)C1(c2cccc(Cl)c2)CCCC1
InChIInChI=1S/C20H21ClN2O3/c1-26-17-8-7-13(18(22)24)11-16(17)23-19(25)20(9-2-3-10-20)14-5-4-6-15(21)12-14/h4-8,11-12H,2-3,9-10H2,1H3,(H2,22,24)(H,23,25)
InChIKeyGKIZHGLAIFIWGG-UHFFFAOYSA-N
MW372.85 g/mol
LogP3.90
Rot. Bonds5

About 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide

3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide (PubChem CID 55783455) has the molecular formula C20H21ClN2O3 and a molecular weight of 372.85 g/mol. Its IUPAC name is 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide.

Molecular Properties

Compound Name3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide
PubChem CID55783455
Molecular FormulaC20H21ClN2O3
Molecular Weight372.85 g/mol
Exact Mass372.12
IUPAC Name3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide
SMILESCOc1ccc(C(N)=O)cc1NC(=O)C1(c2cccc(Cl)c2)CCCC1
InChIInChI=1S/C20H21ClN2O3/c1-26-17-8-7-13(18(22)24)11-16(17)23-19(25)20(9-2-3-10-20)14-5-4-6-15(21)12-14/h4-8,11-12H,2-3,9-10H2,1H3,(H2,22,24)(H,23,25)
InChIKeyGKIZHGLAIFIWGG-UHFFFAOYSA-N
XLogP3.90
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.85
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chlorophenyl)-1-(3,4-dimethoxyphenyl)cyclopentane-1-carboxamide
CID 2014049
N-(3-amino-4-methoxyphenyl)-1-(3-chlorophenyl)cyclopentane-1-carboxamide
CID 119420235
3-[[1-(aminomethyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide
CID 115434921
N-(2,6-dichlorophenyl)-1-(3,4-dimethoxyphenyl)cyclopentane-1-carboxamide
CID 1324116
3-[[(1S)-2,2-dichloro-1-methylcyclopropanecarbonyl]amino]-4-methoxybenzamide
CID 94005114
1-(3-chlorophenyl)-N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)cyclopropane-1-carboxamide
CID 39991041
methyl 4-chloro-3-[(1-phenylcyclopentanecarbonyl)amino]benzoate
CID 100573422
3-[[[1-(3-chlorophenyl)cyclobutanecarbonyl]amino]methyl]benzamide
CID 33097792
3-[(2-amino-1-methylcyclopentanecarbonyl)amino]-4-methoxybenzamide
CID 82763579
1-(3-chlorophenyl)-N-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 110439114
methyl 4-chloro-3-[(1-phenylcyclobutanecarbonyl)amino]benzoate
CID 110438531
1-(3,4-dimethoxyphenyl)-N-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 1234744

Frequently Asked Questions

What is the IUPAC name of 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide?
The IUPAC name of 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide (CID 55783455) is 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide.
What is the SMILES notation for 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide?
The canonical SMILES for 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide is COc1ccc(C(N)=O)cc1NC(=O)C1(c2cccc(Cl)c2)CCCC1.
What is the InChIKey of 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide?
The InChIKey is GKIZHGLAIFIWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN2O3/c1-26-17-8-7-13(18(22)24)11-16(17)23-19(25)20(9-2-3-10-20)14-5-4-6-15(21)12-14/h4-8,11-12H,2-3,9-10H2,1H3,(H2,22,24)(H,23,25).
What are the key properties of 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide?
3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide has a molecular weight of 372.85 g/mol, XLogP of 3.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[1-(3-chlorophenyl)cyclopentanecarbonyl]amino]-4-methoxybenzamide is sourced from PubChem (CID 55783455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).