2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide

C24H24ClN3O3 — CID 133149558

IUPAC2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
SMILESCC(C(=O)NCc1ccccn1)N(Cc1ccc(Cl)cc1)C(=O)COc1ccccc1
InChIInChI=1S/C24H24ClN3O3/c1-18(24(30)27-15-21-7-5-6-14-26-21)28(16-19-10-12-20(25)13-11-19)23(29)17-31-22-8-3-2-4-9-22/h2-14,18H,15-17H2,1H3,(H,27,30)
InChIKeyFNAMYNNRAKINQK-UHFFFAOYSA-N
MW437.93 g/mol
LogP3.85
Rot. Bonds9

About 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide

2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide (PubChem CID 133149558) has the molecular formula C24H24ClN3O3 and a molecular weight of 437.93 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
PubChem CID133149558
Molecular FormulaC24H24ClN3O3
Molecular Weight437.93 g/mol
Exact Mass437.15
IUPAC Name2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
SMILESCC(C(=O)NCc1ccccn1)N(Cc1ccc(Cl)cc1)C(=O)COc1ccccc1
InChIInChI=1S/C24H24ClN3O3/c1-18(24(30)27-15-21-7-5-6-14-26-21)28(16-19-10-12-20(25)13-11-19)23(29)17-31-22-8-3-2-4-9-22/h2-14,18H,15-17H2,1H3,(H,27,30)
InChIKeyFNAMYNNRAKINQK-UHFFFAOYSA-N
XLogP3.85
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.93
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[benzyl-(2-phenylacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133148969
2-[(4-fluorophenyl)methyl-[2-[4-[(4-fluorophenyl)sulfamoyl]phenoxy]acetyl]amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133149661
2-[benzyl-(2-phenoxyacetyl)amino]-N-(pyridin-3-ylmethyl)propanamide
CID 133149053
N-[(2-chlorophenyl)methyl]-2-[(4-fluorophenyl)methyl-(2-phenoxyacetyl)amino]propanamide
CID 133213172
2-[(4-chlorophenyl)methyl-[2-[4-[(4-fluorophenyl)sulfamoyl]phenoxy]acetyl]amino]-2-phenyl-N-(pyridin-2-ylmethyl)acetamide
CID 133237347
2-[(4-methoxyphenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-3-ylmethyl)propanamide
CID 133213694
2-[(4-methoxyphenyl)methyl-[2-(4-morpholin-4-ylsulfonylphenoxy)acetyl]amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133213215
2-[(4-fluorophenyl)methyl-[2-(4-morpholin-4-ylsulfonylphenoxy)acetyl]amino]-N-(pyridin-2-ylmethyl)propanamide
CID 133149592
(2S)-2-[benzyl-[2-(4-chlorophenoxy)acetyl]amino]-N-[(2S)-butan-2-yl]propanamide
CID 100515665
2-[[2-(4-chlorophenoxy)acetyl]-[(4-fluorophenyl)methyl]amino]-N-ethylpropanamide
CID 132659703
2-[(4-chlorophenyl)methyl-[2-(4-morpholin-4-ylsulfonylphenoxy)acetyl]amino]-3-phenyl-N-(pyridin-2-ylmethyl)propanamide
CID 133214240
2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-ethylbutanamide
CID 132659011

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
The IUPAC name of 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide (CID 133149558) is 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide.
What is the SMILES notation for 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
The canonical SMILES for 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide is CC(C(=O)NCc1ccccn1)N(Cc1ccc(Cl)cc1)C(=O)COc1ccccc1.
What is the InChIKey of 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
The InChIKey is FNAMYNNRAKINQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN3O3/c1-18(24(30)27-15-21-7-5-6-14-26-21)28(16-19-10-12-20(25)13-11-19)23(29)17-31-22-8-3-2-4-9-22/h2-14,18H,15-17H2,1H3,(H,27,30).
What are the key properties of 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide?
2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide has a molecular weight of 437.93 g/mol, XLogP of 3.85, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methyl-(2-phenoxyacetyl)amino]-N-(pyridin-2-ylmethyl)propanamide is sourced from PubChem (CID 133149558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).