3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide

C18H25ClN2O — CID 119766559

IUPAC3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)NC2(c3ccc(Cl)cc3)CCCC2)C1
InChIInChI=1S/C18H25ClN2O/c19-15-8-6-14(7-9-15)18(10-1-2-11-18)21-17(22)13-4-3-5-16(20)12-13/h6-9,13,16H,1-5,10-12,20H2,(H,21,22)
InChIKeyCVVCHSMGKVTLTJ-UHFFFAOYSA-N
MW320.86 g/mol
LogP3.74
Rot. Bonds3

About 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide

3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide (PubChem CID 119766559) has the molecular formula C18H25ClN2O and a molecular weight of 320.86 g/mol. Its IUPAC name is 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide
PubChem CID119766559
Molecular FormulaC18H25ClN2O
Molecular Weight320.86 g/mol
Exact Mass320.17
IUPAC Name3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide
SMILESNC1CCCC(C(=O)NC2(c3ccc(Cl)cc3)CCCC2)C1
InChIInChI=1S/C18H25ClN2O/c19-15-8-6-14(7-9-15)18(10-1-2-11-18)21-17(22)13-4-3-5-16(20)12-13/h6-9,13,16H,1-5,10-12,20H2,(H,21,22)
InChIKeyCVVCHSMGKVTLTJ-UHFFFAOYSA-N
XLogP3.74
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.86
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclopentane-1-carboxamide;hydrochloride
CID 119766556
3-amino-N-(1-phenylcyclopentyl)cyclohexane-1-carboxamide
CID 119786235
3-amino-N-[1-(4-methoxyphenyl)cyclopentyl]cyclopentane-1-carboxamide
CID 119760251
3-amino-N-[1-(2-fluorophenyl)cyclopropyl]cyclohexane-1-carboxamide;hydrochloride
CID 119796466
N-[1-(4-chlorophenyl)cyclopentyl]-1-prop-2-enoylpiperidine-3-carboxamide
CID 166413024
3-amino-N-[2-(4-chloroanilino)-2-oxoethyl]cyclohexane-1-carboxamide
CID 119747250
9-amino-N-(1-phenylcyclobutyl)bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120988072
N-[1-(4-fluorophenyl)cyclobutyl]cyclopropanecarboxamide
CID 47408173
3-amino-N-(4-chlorophenyl)cyclopentane-1-carboxamide
CID 66031270
3-amino-N-(2,4,6-trichlorophenyl)cyclohexane-1-carboxamide
CID 63042160
4-amino-N-[1-(4-chlorophenyl)cyclopentyl]butanamide
CID 119313669
cis-(1R,3S)-3-amino-N-[3-(4-chlorophenyl)sulfanylpropyl]cyclohexane-1-carboxamide
CID 77090309

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide?
The IUPAC name of 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide (CID 119766559) is 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide?
The canonical SMILES for 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide is NC1CCCC(C(=O)NC2(c3ccc(Cl)cc3)CCCC2)C1.
What is the InChIKey of 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide?
The InChIKey is CVVCHSMGKVTLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2O/c19-15-8-6-14(7-9-15)18(10-1-2-11-18)21-17(22)13-4-3-5-16(20)12-13/h6-9,13,16H,1-5,10-12,20H2,(H,21,22).
What are the key properties of 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide?
3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide has a molecular weight of 320.86 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[1-(4-chlorophenyl)cyclopentyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 119766559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).