2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide

C24H32N2O2 — CID 132657123

IUPAC2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)N(CCc1ccccc1)C(=O)CCc1ccc(C)cc1
InChIInChI=1S/C24H32N2O2/c1-4-17-25-24(28)20(3)26(18-16-21-8-6-5-7-9-21)23(27)15-14-22-12-10-19(2)11-13-22/h5-13,20H,4,14-18H2,1-3H3,(H,25,28)
InChIKeyCKFKTJAIISHPPY-UHFFFAOYSA-N
MW380.53 g/mol
LogP3.91
Rot. Bonds10

About 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide

2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide (PubChem CID 132657123) has the molecular formula C24H32N2O2 and a molecular weight of 380.53 g/mol. Its IUPAC name is 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide.

Molecular Properties

Compound Name2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide
PubChem CID132657123
Molecular FormulaC24H32N2O2
Molecular Weight380.53 g/mol
Exact Mass380.25
IUPAC Name2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide
SMILESCCCNC(=O)C(C)N(CCc1ccccc1)C(=O)CCc1ccc(C)cc1
InChIInChI=1S/C24H32N2O2/c1-4-17-25-24(28)20(3)26(18-16-21-8-6-5-7-9-21)23(27)15-14-22-12-10-19(2)11-13-22/h5-13,20H,4,14-18H2,1-3H3,(H,25,28)
InChIKeyCKFKTJAIISHPPY-UHFFFAOYSA-N
XLogP3.91
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-methyl-N-methylsulfonylanilino)-N-[(2S)-1-oxo-1-(propylamino)propan-2-yl]-N-(2-phenylethyl)butanamide
CID 100535412
(2R)-2-[[2-(4-methylphenyl)sulfanylacetyl]-(2-phenylethyl)amino]-N-propylpropanamide
CID 100529840
(2R)-2-[3-(2-chlorophenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide
CID 100535585
2-[benzyl(3-phenylpropanoyl)amino]-N-[(4-methylphenyl)methyl]propanamide
CID 133148986
2-[(2-fluorophenyl)methyl-[3-(4-methylphenyl)propanoyl]amino]-N-propylpropanamide
CID 132762793
(2S)-2-[2-phenylethyl(3-phenylsulfanylpropanoyl)amino]-N-propylpropanamide
CID 100530047
N-[1-(butylamino)-1-oxopropan-2-yl]-4-(4-methyl-N-methylsulfonylanilino)-N-(2-phenylethyl)butanamide
CID 132725781
2-[(4-fluorophenyl)methyl-(3-phenylpropanoyl)amino]-N-propylpropanamide
CID 132655615
N-butyl-2-[[2-[(4-methylphenyl)methylsulfanyl]acetyl]-(2-phenylethyl)amino]propanamide
CID 132710628
(2R)-2-[[2-(2,5-dimethylphenoxy)acetyl]-(2-phenylethyl)amino]-N-propylpropanamide
CID 100534809
2-[(4-methylphenyl)methyl-(2-phenylacetyl)amino]-N-propylpropanamide
CID 132653203
2-[benzyl(3-phenylpropanoyl)amino]-N-butylpropanamide
CID 132701689

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide?
The IUPAC name of 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide (CID 132657123) is 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide.
What is the SMILES notation for 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide?
The canonical SMILES for 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide is CCCNC(=O)C(C)N(CCc1ccccc1)C(=O)CCc1ccc(C)cc1.
What is the InChIKey of 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide?
The InChIKey is CKFKTJAIISHPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O2/c1-4-17-25-24(28)20(3)26(18-16-21-8-6-5-7-9-21)23(27)15-14-22-12-10-19(2)11-13-22/h5-13,20H,4,14-18H2,1-3H3,(H,25,28).
What are the key properties of 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide?
2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide has a molecular weight of 380.53 g/mol, XLogP of 3.91, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-methylphenyl)propanoyl-(2-phenylethyl)amino]-N-propylpropanamide is sourced from PubChem (CID 132657123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).