N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide

C15H20ClNO — CID 1121692

IUPACN-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide
SMILESO=C(CC1CCCCC1)NCc1ccc(Cl)cc1
InChIInChI=1S/C15H20ClNO/c16-14-8-6-13(7-9-14)11-17-15(18)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18)
InChIKeyWLKJGOLIAWLPPE-UHFFFAOYSA-N
MW265.78 g/mol
LogP3.93
Rot. Bonds4

About N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide

N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide (PubChem CID 1121692) has the molecular formula C15H20ClNO and a molecular weight of 265.78 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide
PubChem CID1121692
Molecular FormulaC15H20ClNO
Molecular Weight265.78 g/mol
Exact Mass265.12
IUPAC NameN-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide
SMILESO=C(CC1CCCCC1)NCc1ccc(Cl)cc1
InChIInChI=1S/C15H20ClNO/c16-14-8-6-13(7-9-14)11-17-15(18)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18)
InChIKeyWLKJGOLIAWLPPE-UHFFFAOYSA-N
XLogP3.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Carpropamide
CID 449402
Carpropamid
CID 153847
2-Chloro-N-phenethyl-benzamide
CID 692233
N-benzyl-4-chlorobenzamide
CID 346668
N-[(4-chlorophenyl)methyl]-4-ethylbenzamide
CID 2097068
4-chloro-N-(2-oxo-2-phenylethyl)benzamide
CID 832101
N-benzyl-2-cyclohexylacetamide
CID 880904
4-Chloro-N-phenethylbenzamide
CID 306479
N-Benzyl-2-chloro-benzamide
CID 347073
Benzamide, 4-chloro-N-methyl-
CID 101339
4-Chloro-N-(5-hydroxycarbamoyl-pentyl)-benzamide
CID 403373
Benzamide derivative 11
CID 41306362

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide (CID 1121692) is N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide is O=C(CC1CCCCC1)NCc1ccc(Cl)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide?
The InChIKey is WLKJGOLIAWLPPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO/c16-14-8-6-13(7-9-14)11-17-15(18)10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,17,18).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide?
N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide has a molecular weight of 265.78 g/mol, XLogP of 3.93, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-cyclohexylacetamide is sourced from PubChem (CID 1121692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).