2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide

C23H30N2O2 — CID 133148978

IUPAC2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide
SMILESCC(C)CCNC(=O)C(C)N(Cc1ccccc1)C(=O)Cc1ccccc1
InChIInChI=1S/C23H30N2O2/c1-18(2)14-15-24-23(27)19(3)25(17-21-12-8-5-9-13-21)22(26)16-20-10-6-4-7-11-20/h4-13,18-19H,14-17H2,1-3H3,(H,24,27)
InChIKeyJOGXFCVQVURRCN-UHFFFAOYSA-N
MW366.50 g/mol
LogP3.81
Rot. Bonds9

About 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide

2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide (PubChem CID 133148978) has the molecular formula C23H30N2O2 and a molecular weight of 366.50 g/mol. Its IUPAC name is 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide.

Molecular Properties

Compound Name2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide
PubChem CID133148978
Molecular FormulaC23H30N2O2
Molecular Weight366.50 g/mol
Exact Mass366.23
IUPAC Name2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide
SMILESCC(C)CCNC(=O)C(C)N(Cc1ccccc1)C(=O)Cc1ccccc1
InChIInChI=1S/C23H30N2O2/c1-18(2)14-15-24-23(27)19(3)25(17-21-12-8-5-9-13-21)22(26)16-20-10-6-4-7-11-20/h4-13,18-19H,14-17H2,1-3H3,(H,24,27)
InChIKeyJOGXFCVQVURRCN-UHFFFAOYSA-N
XLogP3.81
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.50
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[benzyl-(2-phenylacetyl)amino]-N-(2-hydroxyethyl)propanamide
CID 133148954
N-benzyl-2-methyl-N-[1-(3-methylbutylamino)-1-oxopropan-2-yl]propanamide
CID 133148950
2-[benzyl-(2-phenylacetyl)amino]-N-pentylpropanamide
CID 133148977
(2R)-2-[benzyl-(2-phenylacetyl)amino]-N-propan-2-ylpropanamide
CID 100638766
2-[benzyl-(2-phenylacetyl)amino]-N-[(4-methylphenyl)methyl]propanamide
CID 133148959
2-[(4-methylphenyl)methyl-(2-phenylacetyl)amino]-N-propylpropanamide
CID 132653203
2-[benzyl-[2-(4-chlorophenyl)acetyl]amino]-N-propylpropanamide
CID 132656017
2-[(4-chlorophenyl)methyl-(2-phenylacetyl)amino]-N-propylpropanamide
CID 132656046
2-[(4-chlorophenyl)methyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)-3-phenylpropanamide
CID 133214644
2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133148969
(2S)-2-[benzyl-[2-(4-methylphenyl)acetyl]amino]-N-propan-2-ylpropanamide
CID 100645911
(2S)-2-[(4-methylphenyl)methyl-(2-phenylacetyl)amino]-N-propan-2-ylpropanamide
CID 100663135

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide?
The IUPAC name of 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide (CID 133148978) is 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide.
What is the SMILES notation for 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide?
The canonical SMILES for 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide is CC(C)CCNC(=O)C(C)N(Cc1ccccc1)C(=O)Cc1ccccc1.
What is the InChIKey of 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide?
The InChIKey is JOGXFCVQVURRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-18(2)14-15-24-23(27)19(3)25(17-21-12-8-5-9-13-21)22(26)16-20-10-6-4-7-11-20/h4-13,18-19H,14-17H2,1-3H3,(H,24,27).
What are the key properties of 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide?
2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide has a molecular weight of 366.50 g/mol, XLogP of 3.81, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl-(2-phenylacetyl)amino]-N-(3-methylbutyl)propanamide is sourced from PubChem (CID 133148978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).