(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide

C22H26ClNO — CID 158787869

IUPAC(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide
SMILESCc1ccc(C2CCC([C@@H](C)C(=O)Nc3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C22H26ClNO/c1-15-3-5-18(6-4-15)19-9-7-17(8-10-19)16(2)22(25)24-21-13-11-20(23)12-14-21/h3-6,11-14,16-17,19H,7-10H2,1-2H3,(H,24,25)/t16-,17?,19?/m1/s1
InChIKeyIRXIHXZUNZXRKW-LRYGQEGESA-N
MW355.91 g/mol
LogP6.20
Rot. Bonds4

About (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide

(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide (PubChem CID 158787869) has the molecular formula C22H26ClNO and a molecular weight of 355.91 g/mol. Its IUPAC name is (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide.

Molecular Properties

Compound Name(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide
PubChem CID158787869
Molecular FormulaC22H26ClNO
Molecular Weight355.91 g/mol
Exact Mass355.17
IUPAC Name(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide
SMILESCc1ccc(C2CCC([C@@H](C)C(=O)Nc3ccc(Cl)cc3)CC2)cc1
InChIInChI=1S/C22H26ClNO/c1-15-3-5-18(6-4-15)19-9-7-17(8-10-19)16(2)22(25)24-21-13-11-20(23)12-14-21/h3-6,11-14,16-17,19H,7-10H2,1-2H3,(H,24,25)/t16-,17?,19?/m1/s1
InChIKeyIRXIHXZUNZXRKW-LRYGQEGESA-N
XLogP6.20
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.91
LogP ≤ 56.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-N-(4-methylphenyl)-2-[4-(2-methyl-4-pyridinyl)cyclohexyl]propanamide
CID 162028451
N-(4-chlorophenyl)-2-(4-ethylcyclohexyl)propanamide
CID 137389651
N-(4-chlorophenyl)-2-[4-(2-methylpyrimidin-4-yl)cyclohexyl]propanamide
CID 138490234
N-(4-fluorophenyl)-2-(4-phenylcyclohexyl)propanamide
CID 121325032
N-(4-chlorophenyl)-2-[4-(2-fluoro-3-methyl-4-pyridinyl)cyclohexyl]propanamide
CID 138490241
(2R)-N-(4-cyanophenyl)-2-(4-phenylcyclohexyl)propanamide
CID 121325031
2-cyclopropyl-N-(3,4-difluorophenyl)propanamide
CID 110428971
N-(4-chlorophenyl)-2-[4-[(3-methylphenyl)methoxy]cyclohexyl]propanamide
CID 138553761
2-cyclopropyl-N-[4-(1-hydroxyethyl)phenyl]propanamide
CID 83148427
2-cyclopropyl-N-[4-(methylaminomethyl)phenyl]propanamide
CID 106909989
N-(4-chlorophenyl)-2-[4-(8-fluoroquinolin-4-yl)cyclohexyl]propanamide
CID 129088634
N-(4-chlorophenyl)-4-[1-(2,4-dimethylanilino)-1-oxopropan-2-yl]piperidine-1-carboxamide
CID 53057941

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide?
The IUPAC name of (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide (CID 158787869) is (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide.
What is the SMILES notation for (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide?
The canonical SMILES for (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide is Cc1ccc(C2CCC([C@@H](C)C(=O)Nc3ccc(Cl)cc3)CC2)cc1.
What is the InChIKey of (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide?
The InChIKey is IRXIHXZUNZXRKW-LRYGQEGESA-N. The full InChI is InChI=1S/C22H26ClNO/c1-15-3-5-18(6-4-15)19-9-7-17(8-10-19)16(2)22(25)24-21-13-11-20(23)12-14-21/h3-6,11-14,16-17,19H,7-10H2,1-2H3,(H,24,25)/t16-,17?,19?/m1/s1.
What are the key properties of (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide?
(2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide has a molecular weight of 355.91 g/mol, XLogP of 6.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-chlorophenyl)-2-[4-(4-methylphenyl)cyclohexyl]propanamide is sourced from PubChem (CID 158787869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).