N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide

C17H24ClNO — CID 137389651

IUPACN-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide
SMILESCCC1CCC(C(C)C(=O)Nc2ccc(Cl)cc2)CC1
InChIInChI=1S/C17H24ClNO/c1-3-13-4-6-14(7-5-13)12(2)17(20)19-16-10-8-15(18)9-11-16/h8-14H,3-7H2,1-2H3,(H,19,20)
InChIKeyLSIXRKOLQNIRHN-UHFFFAOYSA-N
MW293.84 g/mol
LogP5.13
Rot. Bonds4

About N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide

N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide (PubChem CID 137389651) has the molecular formula C17H24ClNO and a molecular weight of 293.84 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide
PubChem CID137389651
Molecular FormulaC17H24ClNO
Molecular Weight293.84 g/mol
Exact Mass293.15
IUPAC NameN-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide
SMILESCCC1CCC(C(C)C(=O)Nc2ccc(Cl)cc2)CC1
InChIInChI=1S/C17H24ClNO/c1-3-13-4-6-14(7-5-13)12(2)17(20)19-16-10-8-15(18)9-11-16/h8-14H,3-7H2,1-2H3,(H,19,20)
InChIKeyLSIXRKOLQNIRHN-UHFFFAOYSA-N
XLogP5.13
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.84
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide
CID 158787869
2-cyclopropyl-N-(3,4-difluorophenyl)propanamide
CID 110428971
4-[1-(4-acetylanilino)-1-oxopropan-2-yl]-N-(4-chlorophenyl)piperidine-1-carboxamide
CID 46295328
2-cyclopropyl-N-[4-(1-hydroxyethyl)phenyl]propanamide
CID 83148427
2-cyclopropyl-N-[4-(methylaminomethyl)phenyl]propanamide
CID 106909989
N-(4-chlorophenyl)-2-[4-(2-methylpyrimidin-4-yl)cyclohexyl]propanamide
CID 138490234
N-(4-chlorophenyl)-2-[4-[(3-methylphenyl)methoxy]cyclohexyl]propanamide
CID 138553761
N-(4-chlorophenyl)-2-[4-(2-fluoro-3-methyl-4-pyridinyl)cyclohexyl]propanamide
CID 138490241
(2R)-N-(4-fluorophenyl)-2-(4-methylcyclohexyl)propanamide
CID 138502747
[1-(4-chloroanilino)-3-cyclopropyl-1-oxopropan-2-yl] methanesulfonate
CID 153354336
2-cyclopropyl-N-(3,5-dichloro-4-hydroxyphenyl)propanamide
CID 83154434
N-(4-chlorophenyl)-2-[4-(8-fluoroquinolin-4-yl)cyclohexyl]propanamide
CID 129088634

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide?
The IUPAC name of N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide (CID 137389651) is N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide is CCC1CCC(C(C)C(=O)Nc2ccc(Cl)cc2)CC1.
What is the InChIKey of N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide?
The InChIKey is LSIXRKOLQNIRHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24ClNO/c1-3-13-4-6-14(7-5-13)12(2)17(20)19-16-10-8-15(18)9-11-16/h8-14H,3-7H2,1-2H3,(H,19,20).
What are the key properties of N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide?
N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide has a molecular weight of 293.84 g/mol, XLogP of 5.13, 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-ethylcyclohexyl)propanamide is sourced from PubChem (CID 137389651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).