N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide

C29H26N2O2 — CID 159838586

IUPACN-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide
SMILESCN(C(=O)c1ccc(CC(=O)CCc2cccnc2)cc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C29H26N2O2/c1-31(28-12-6-5-11-27(28)24-9-3-2-4-10-24)29(33)25-16-13-22(14-17-25)20-26(32)18-15-23-8-7-19-30-21-23/h2-14,16-17,19,21H,15,18,20H2,1H3
InChIKeyNOJXDUBZSIILBL-UHFFFAOYSA-N
MW434.54 g/mol
LogP5.77
Rot. Bonds8

About N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide

N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide (PubChem CID 159838586) has the molecular formula C29H26N2O2 and a molecular weight of 434.54 g/mol. Its IUPAC name is N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide.

Molecular Properties

Compound NameN-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide
PubChem CID159838586
Molecular FormulaC29H26N2O2
Molecular Weight434.54 g/mol
Exact Mass434.20
IUPAC NameN-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide
SMILESCN(C(=O)c1ccc(CC(=O)CCc2cccnc2)cc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C29H26N2O2/c1-31(28-12-6-5-11-27(28)24-9-3-2-4-10-24)29(33)25-16-13-22(14-17-25)20-26(32)18-15-23-8-7-19-30-21-23/h2-14,16-17,19,21H,15,18,20H2,1H3
InChIKeyNOJXDUBZSIILBL-UHFFFAOYSA-N
XLogP5.77
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.54
LogP ≤ 55.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide 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

N-methyl-N-[4-(2-oxo-4-pyridin-3-ylbutyl)phenyl]-2-phenylbenzenesulfonamide
CID 153188468
1-[4-[(2-phenylphenyl)sulfinylmethyl]phenyl]-4-pyridin-3-ylbutan-2-one
CID 160725556
1-[4-[(2-phenylphenyl)methylsulfonyl]phenyl]-4-pyridin-3-ylbutan-2-one
CID 147366026
1-[4-[3-methylbutyl-[(2-phenylphenyl)methyl]amino]phenyl]-4-pyridin-3-ylbutan-2-one
CID 158916420
1-[4-[2-(4-tert-butylphenyl)acetyl]phenyl]-4-pyridin-3-ylbutan-2-one
CID 159913920
1-[4-[(4-hydroxy-2-phenylphenoxy)methyl]phenyl]-4-pyridin-3-ylbutan-2-one
CID 158616278
5-[4-(2-methylphenyl)phenyl]-1-pyridin-3-ylpentan-2-one
CID 147437155
1-pyridin-3-yl-4-pyridin-4-ylbutan-2-one
CID 105127753
N-[4-(2-oxo-4-pyridin-3-ylbutyl)phenyl]methanesulfonamide
CID 158830011
1-[4-[2-(2-phenylphenoxy)ethyl]phenyl]-5-pyridin-3-ylpentan-3-one
CID 161218942
N-[4-(2-oxo-4-pyridin-3-ylbutyl)phenyl]-1-phenylmethanesulfonamide
CID 147985975
3-[2-[2-[4-(2-oxo-4-pyridin-3-ylbutyl)phenoxy]ethyl]phenyl]benzoic acid
CID 149033960

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide?
The IUPAC name of N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide (CID 159838586) is N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide.
What is the SMILES notation for N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide?
The canonical SMILES for N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide is CN(C(=O)c1ccc(CC(=O)CCc2cccnc2)cc1)c1ccccc1-c1ccccc1.
What is the InChIKey of N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide?
The InChIKey is NOJXDUBZSIILBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H26N2O2/c1-31(28-12-6-5-11-27(28)24-9-3-2-4-10-24)29(33)25-16-13-22(14-17-25)20-26(32)18-15-23-8-7-19-30-21-23/h2-14,16-17,19,21H,15,18,20H2,1H3.
What are the key properties of N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide?
N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide has a molecular weight of 434.54 g/mol, XLogP of 5.77, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(2-oxo-4-pyridin-3-ylbutyl)-N-(2-phenylphenyl)benzamide is sourced from PubChem (CID 159838586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).