N-benzyl-2-[benzyl(propanoyl)amino]propanamide

C20H24N2O2 — CID 133148772

IUPACN-benzyl-2-[benzyl(propanoyl)amino]propanamide
SMILESCCC(=O)N(Cc1ccccc1)C(C)C(=O)NCc1ccccc1
InChIInChI=1S/C20H24N2O2/c1-3-19(23)22(15-18-12-8-5-9-13-18)16(2)20(24)21-14-17-10-6-4-7-11-17/h4-13,16H,3,14-15H2,1-2H3,(H,21,24)
InChIKeyKORKQTIQCXECPE-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.13
Rot. Bonds7

About N-benzyl-2-[benzyl(propanoyl)amino]propanamide

N-benzyl-2-[benzyl(propanoyl)amino]propanamide (PubChem CID 133148772) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-benzyl-2-[benzyl(propanoyl)amino]propanamide.

Molecular Properties

Compound NameN-benzyl-2-[benzyl(propanoyl)amino]propanamide
PubChem CID133148772
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-benzyl-2-[benzyl(propanoyl)amino]propanamide
SMILESCCC(=O)N(Cc1ccccc1)C(C)C(=O)NCc1ccccc1
InChIInChI=1S/C20H24N2O2/c1-3-19(23)22(15-18-12-8-5-9-13-18)16(2)20(24)21-14-17-10-6-4-7-11-17/h4-13,16H,3,14-15H2,1-2H3,(H,21,24)
InChIKeyKORKQTIQCXECPE-UHFFFAOYSA-N
XLogP3.13
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[benzyl-(2-phenylacetyl)amino]-N-[(4-methylphenyl)methyl]propanamide
CID 133148959
2-[benzyl(3-phenylpropanoyl)amino]-N-[(4-methylphenyl)methyl]propanamide
CID 133148986
2-[benzyl-(2-phenylacetyl)amino]-N-pentylpropanamide
CID 133148977
2-[benzyl-(2-phenylacetyl)amino]-N-(2-hydroxyethyl)propanamide
CID 133148954
2-[benzyl(3-phenylpropanoyl)amino]-N-butylpropanamide
CID 132701689
2-[(4-chlorophenyl)methyl-(2-phenylacetyl)amino]-N-(pyridin-4-ylmethyl)propanamide
CID 133149475
N-[(2-chlorophenyl)methyl]-2-[(4-methoxyphenyl)methyl-propanoylamino]propanamide
CID 133213514
2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide
CID 133148978
2-[benzyl(propanoyl)amino]-N-propan-2-ylbutanamide
CID 132649938
(2R)-2-[benzyl(propanoyl)amino]-N-(2-methylpropyl)-3-phenylpropanamide
CID 100741850
2-[(4-methylphenyl)methyl-(2-phenylacetyl)amino]-N-propylpropanamide
CID 132653203
2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133148969

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[benzyl(propanoyl)amino]propanamide?
The IUPAC name of N-benzyl-2-[benzyl(propanoyl)amino]propanamide (CID 133148772) is N-benzyl-2-[benzyl(propanoyl)amino]propanamide.
What is the SMILES notation for N-benzyl-2-[benzyl(propanoyl)amino]propanamide?
The canonical SMILES for N-benzyl-2-[benzyl(propanoyl)amino]propanamide is CCC(=O)N(Cc1ccccc1)C(C)C(=O)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-[benzyl(propanoyl)amino]propanamide?
The InChIKey is KORKQTIQCXECPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-3-19(23)22(15-18-12-8-5-9-13-18)16(2)20(24)21-14-17-10-6-4-7-11-17/h4-13,16H,3,14-15H2,1-2H3,(H,21,24).
What are the key properties of N-benzyl-2-[benzyl(propanoyl)amino]propanamide?
N-benzyl-2-[benzyl(propanoyl)amino]propanamide has a molecular weight of 324.42 g/mol, XLogP of 3.13, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[benzyl(propanoyl)amino]propanamide is sourced from PubChem (CID 133148772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).