N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide

C19H23ClN2O — CID 55850747

IUPACN-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide
SMILESCN(CCCc1ccccc1)CCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C19H23ClN2O/c1-22(14-5-8-16-6-3-2-4-7-16)15-13-19(23)21-18-11-9-17(20)10-12-18/h2-4,6-7,9-12H,5,8,13-15H2,1H3,(H,21,23)
InChIKeyZXBUDRGHSQNCBT-UHFFFAOYSA-N
MW330.86 g/mol
LogP4.23
Rot. Bonds8

About N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide

N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide (PubChem CID 55850747) has the molecular formula C19H23ClN2O and a molecular weight of 330.86 g/mol. Its IUPAC name is N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide
PubChem CID55850747
Molecular FormulaC19H23ClN2O
Molecular Weight330.86 g/mol
Exact Mass330.15
IUPAC NameN-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide
SMILESCN(CCCc1ccccc1)CCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C19H23ClN2O/c1-22(14-5-8-16-6-3-2-4-7-16)15-13-19(23)21-18-11-9-17(20)10-12-18/h2-4,6-7,9-12H,5,8,13-15H2,1H3,(H,21,23)
InChIKeyZXBUDRGHSQNCBT-UHFFFAOYSA-N
XLogP4.23
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.86
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[benzyl(methyl)amino]-N-(4-chlorophenyl)propanamide
CID 882844
3-[acetyl(2-phenylethyl)amino]-N-(4-chlorophenyl)propanamide
CID 113120836
3-[3-(4-chlorophenyl)propyl-methylamino]propanoic acid
CID 19776431
N-[2-(4-chloroanilino)-2-oxoethyl]-N-methyl-3-phenylpropanamide
CID 4781646
2-[[2-(4-chloroanilino)-2-oxoethyl]-methylamino]-N-(2-phenylethyl)acetamide
CID 18078825
3-[(3-anilino-3-oxopropyl)-methylamino]propanoic acid
CID 60987692
N-(4-acetamidophenyl)-3-[benzyl(methyl)amino]propanamide
CID 109020641
N-[4-(dimethylamino)phenyl]-3-phenylpropanamide
CID 874810
3-[acetyl(3-phenylpropyl)amino]-N-(3,4-dichlorophenyl)propanamide
CID 113122324
N-(4-chlorophenyl)-N'-[(2S)-4-phenylbutan-2-yl]butanediamide
CID 7316761
N-(4-chlorophenyl)-N'-[(2R)-4-phenylbutan-2-yl]butanediamide
CID 7316762
3-amino-N-[4-(3-phenylpropyl)phenyl]propanamide;hydrochloride
CID 119315336

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide?
The IUPAC name of N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide (CID 55850747) is N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide?
The canonical SMILES for N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide is CN(CCCc1ccccc1)CCC(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide?
The InChIKey is ZXBUDRGHSQNCBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O/c1-22(14-5-8-16-6-3-2-4-7-16)15-13-19(23)21-18-11-9-17(20)10-12-18/h2-4,6-7,9-12H,5,8,13-15H2,1H3,(H,21,23).
What are the key properties of N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide?
N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide has a molecular weight of 330.86 g/mol, XLogP of 4.23, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-3-[methyl(3-phenylpropyl)amino]propanamide is sourced from PubChem (CID 55850747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).