N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide

C20H24ClNO — CID 54782252

IUPACN-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCC(C)Cc1ccc(C(C)C(=O)NCc2ccccc2Cl)cc1
InChIInChI=1S/C20H24ClNO/c1-14(2)12-16-8-10-17(11-9-16)15(3)20(23)22-13-18-6-4-5-7-19(18)21/h4-11,14-15H,12-13H2,1-3H3,(H,22,23)
InChIKeySZVMDRCWLWPJOW-UHFFFAOYSA-N
MW329.87 g/mol
LogP4.96
Rot. Bonds6

About N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide

N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide (PubChem CID 54782252) has the molecular formula C20H24ClNO and a molecular weight of 329.87 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide
PubChem CID54782252
Molecular FormulaC20H24ClNO
Molecular Weight329.87 g/mol
Exact Mass329.15
IUPAC NameN-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide
SMILESCC(C)Cc1ccc(C(C)C(=O)NCc2ccccc2Cl)cc1
InChIInChI=1S/C20H24ClNO/c1-14(2)12-16-8-10-17(11-9-16)15(3)20(23)22-13-18-6-4-5-7-19(18)21/h4-11,14-15H,12-13H2,1-3H3,(H,22,23)
InChIKeySZVMDRCWLWPJOW-UHFFFAOYSA-N
XLogP4.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.87
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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4-Chloro-N-phenethylbenzamide
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N-Benzyl-2-chloro-benzamide
CID 347073
N-(1-(4-chlorophenyl)-3-(dimethylamino)propyl)-4-phenylbenzamide
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Benzamide derivative 11
CID 41306362
2-Chloro-N-(2-phenyl-propyl)-benzamide
CID 3116854
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CID 885659

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide (CID 54782252) is N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide is CC(C)Cc1ccc(C(C)C(=O)NCc2ccccc2Cl)cc1.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide?
The InChIKey is SZVMDRCWLWPJOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24ClNO/c1-14(2)12-16-8-10-17(11-9-16)15(3)20(23)22-13-18-6-4-5-7-19(18)21/h4-11,14-15H,12-13H2,1-3H3,(H,22,23).
What are the key properties of N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide?
N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide has a molecular weight of 329.87 g/mol, XLogP of 4.96, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-[4-(2-methylpropyl)phenyl]propanamide is sourced from PubChem (CID 54782252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).