2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide

C24H25N3O2 — CID 133148969

IUPAC2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
SMILESCC(C(=O)NCc1ccccn1)N(Cc1ccccc1)C(=O)Cc1ccccc1
InChIInChI=1S/C24H25N3O2/c1-19(24(29)26-17-22-14-8-9-15-25-22)27(18-21-12-6-3-7-13-21)23(28)16-20-10-4-2-5-11-20/h2-15,19H,16-18H2,1H3,(H,26,29)
InChIKeyBDFAMHOODUCVKC-UHFFFAOYSA-N
MW387.48 g/mol
LogP3.36
Rot. Bonds8

About 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide

2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 133148969) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
PubChem CID133148969
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
SMILESCC(C(=O)NCc1ccccn1)N(Cc1ccccc1)C(=O)Cc1ccccc1
InChIInChI=1S/C24H25N3O2/c1-19(24(29)26-17-22-14-8-9-15-25-22)27(18-21-12-6-3-7-13-21)23(28)16-20-10-4-2-5-11-20/h2-15,19H,16-18H2,1H3,(H,26,29)
InChIKeyBDFAMHOODUCVKC-UHFFFAOYSA-N
XLogP3.36
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.48
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-methoxyphenyl)methyl-(2-phenylacetyl)amino]-2-phenyl-N-(pyridin-2-ylmethyl)acetamide
CID 133238795
2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133149558
2-[benzyl-(2-phenylacetyl)amino]-N-(2-hydroxyethyl)propanamide
CID 133148954
2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide
CID 133148978
2-[(4-chlorophenyl)methyl-(2-phenylacetyl)amino]-N-(pyridin-4-ylmethyl)propanamide
CID 133149475
2-[benzyl-(2-phenylacetyl)amino]-N-pentylpropanamide
CID 133148977
(2R)-2-[benzyl-(2-phenylacetyl)amino]-N-propan-2-ylpropanamide
CID 100638766
2-[[2-(4-chlorophenyl)acetyl]-[(4-fluorophenyl)methyl]amino]-2-phenyl-N-(pyridin-2-ylmethyl)acetamide
CID 133238311
N-benzyl-2-[benzyl(propanoyl)amino]propanamide
CID 133148772
2-[(4-methylphenyl)methyl-(2-phenylacetyl)amino]-N-propylpropanamide
CID 132653203
N-benzyl-2,2-dimethyl-N-propan-2-yl-N'-(pyridin-2-ylmethyl)propanediamide
CID 108963371
2-[(4-chlorophenyl)methyl-(2-phenylacetyl)amino]-N-propylpropanamide
CID 132656046

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide (CID 133148969) is 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide is CC(C(=O)NCc1ccccn1)N(Cc1ccccc1)C(=O)Cc1ccccc1.
What is the InChIKey of 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is BDFAMHOODUCVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-19(24(29)26-17-22-14-8-9-15-25-22)27(18-21-12-6-3-7-13-21)23(28)16-20-10-4-2-5-11-20/h2-15,19H,16-18H2,1H3,(H,26,29).
What are the key properties of 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 387.48 g/mol, XLogP of 3.36, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 133148969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).