N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide

C21H24ClNO — CID 161440636

IUPACN-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
SMILESCc1cccc(C2CCC(CC(=O)Nc3ccc(Cl)cc3)CC2)c1
InChIInChI=1S/C21H24ClNO/c1-15-3-2-4-18(13-15)17-7-5-16(6-8-17)14-21(24)23-20-11-9-19(22)10-12-20/h2-4,9-13,16-17H,5-8,14H2,1H3,(H,23,24)
InChIKeyVZFLHNCWRMGYLI-UHFFFAOYSA-N
MW341.88 g/mol
LogP5.95
Rot. Bonds4

About N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide

N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide (PubChem CID 161440636) has the molecular formula C21H24ClNO and a molecular weight of 341.88 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
PubChem CID161440636
Molecular FormulaC21H24ClNO
Molecular Weight341.88 g/mol
Exact Mass341.15
IUPAC NameN-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
SMILESCc1cccc(C2CCC(CC(=O)Nc3ccc(Cl)cc3)CC2)c1
InChIInChI=1S/C21H24ClNO/c1-15-3-2-4-18(13-15)17-7-5-16(6-8-17)14-21(24)23-20-11-9-19(22)10-12-20/h2-4,9-13,16-17H,5-8,14H2,1H3,(H,23,24)
InChIKeyVZFLHNCWRMGYLI-UHFFFAOYSA-N
XLogP5.95
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.88
LogP ≤ 55.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-chloro-3-fluorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
CID 146986934
3-[4-[2-(4-chloroanilino)-2-oxoethyl]cyclohexyl]benzoic acid
CID 121319777
bis(2-[4-(4-chloro-2-fluorophenyl)cyclohexyl]-N-(4-chlorophenyl)acetamide);methane
CID 167552414
N-(4-chlorophenyl)-2-[4-(4-ethoxyphenyl)cyclohexyl]acetamide
CID 121325219
N-(4-chlorophenyl)-2-[4-(2,3-difluorophenyl)cyclohexyl]acetamide
CID 174865886
2-(4-acetylcyclohexyl)-N-(4-chlorophenyl)acetamide
CID 121319520
ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide
CID 145078209
N-(4-chlorophenyl)-2-[4-(2,4-dimethoxyphenyl)cyclohexyl]acetamide
CID 121324026
N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide
CID 121325134
N-(4-chloro-2-fluorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]acetamide
CID 160996728
N-(4-cyanophenyl)-2-[4-[3-(nitrosomethyl)phenyl]cyclohexyl]acetamide
CID 138502772
N-(4-chlorophenyl)-2-(1,1-dioxothian-4-yl)acetamide
CID 110858953

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide (CID 161440636) is N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide is Cc1cccc(C2CCC(CC(=O)Nc3ccc(Cl)cc3)CC2)c1.
What is the InChIKey of N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide?
The InChIKey is VZFLHNCWRMGYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClNO/c1-15-3-2-4-18(13-15)17-7-5-16(6-8-17)14-21(24)23-20-11-9-19(22)10-12-20/h2-4,9-13,16-17H,5-8,14H2,1H3,(H,23,24).
What are the key properties of N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide?
N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide has a molecular weight of 341.88 g/mol, XLogP of 5.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide is sourced from PubChem (CID 161440636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).