1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide

C18H18ClNO — CID 22236982

IUPAC1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide
SMILESO=C(Nc1ccccc1)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C18H18ClNO/c19-15-10-8-14(9-11-15)18(12-4-5-13-18)17(21)20-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-13H2,(H,20,21)
InChIKeyNHWAYZKWMRUURO-UHFFFAOYSA-N
MW299.80 g/mol
LogP4.79
Rot. Bonds3

About 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide

1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide (PubChem CID 22236982) has the molecular formula C18H18ClNO and a molecular weight of 299.80 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide
PubChem CID22236982
Molecular FormulaC18H18ClNO
Molecular Weight299.80 g/mol
Exact Mass299.11
IUPAC Name1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide
SMILESO=C(Nc1ccccc1)C1(c2ccc(Cl)cc2)CCCC1
InChIInChI=1S/C18H18ClNO/c19-15-10-8-14(9-11-15)18(12-4-5-13-18)17(21)20-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-13H2,(H,20,21)
InChIKeyNHWAYZKWMRUURO-UHFFFAOYSA-N
XLogP4.79
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.80
LogP ≤ 54.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[4-[[1-(4-chlorophenyl)cyclopentanecarbonyl]amino]phenoxy]acetic acid
CID 100665395
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1-(4-aminophenyl)-N-(4-chlorophenyl)cyclopropane-1-carboxamide
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N-(4-chlorophenyl)-1-phenylcyclopent-3-ene-1-carboxamide
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N-(3,4-difluorophenyl)-1-phenylcyclopentane-1-carboxamide
CID 4646133
1-(4-aminophenyl)-N-phenylcyclopropane-1-carboxamide
CID 99613024
1-(4-chlorophenyl)-N-(3-ethynylphenyl)cyclobutane-1-carboxamide
CID 55514323
1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 2525284
N-(4-chlorophenyl)-1-(2-fluorophenyl)cyclobutane-1-carboxamide
CID 110438567
N-[(4-chlorophenyl)methyl]-1-phenylcyclopentane-1-carboxamide
CID 35571496
1-(4-chlorophenyl)-N-[[1-(hydroxymethyl)cyclopentyl]methyl]cyclopropane-1-carboxamide
CID 115362498
1-(4-chlorophenyl)-N-(2-methoxypyrimidin-5-yl)cyclopentane-1-carboxamide
CID 122301531

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide (CID 22236982) is 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide is O=C(Nc1ccccc1)C1(c2ccc(Cl)cc2)CCCC1.
What is the InChIKey of 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide?
The InChIKey is NHWAYZKWMRUURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18ClNO/c19-15-10-8-14(9-11-15)18(12-4-5-13-18)17(21)20-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-13H2,(H,20,21).
What are the key properties of 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide?
1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide has a molecular weight of 299.80 g/mol, XLogP of 4.79, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 22236982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).