2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide

C20H17ClN2O2 — CID 170430933

IUPAC2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide
SMILESCc1cccc(Cl)c1C(=O)NCc1ccc(-c2cccc(=O)[nH]2)cc1
InChIInChI=1S/C20H17ClN2O2/c1-13-4-2-5-16(21)19(13)20(25)22-12-14-8-10-15(11-9-14)17-6-3-7-18(24)23-17/h2-11H,12H2,1H3,(H,22,25)(H,23,24)
InChIKeyJXHZFLRNVLCJFW-UHFFFAOYSA-N
MW352.82 g/mol
LogP3.93
Rot. Bonds4

About 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide

2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide (PubChem CID 170430933) has the molecular formula C20H17ClN2O2 and a molecular weight of 352.82 g/mol. Its IUPAC name is 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide
PubChem CID170430933
Molecular FormulaC20H17ClN2O2
Molecular Weight352.82 g/mol
Exact Mass352.10
IUPAC Name2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide
SMILESCc1cccc(Cl)c1C(=O)NCc1ccc(-c2cccc(=O)[nH]2)cc1
InChIInChI=1S/C20H17ClN2O2/c1-13-4-2-5-16(21)19(13)20(25)22-12-14-8-10-15(11-9-14)17-6-3-7-18(24)23-17/h2-11H,12H2,1H3,(H,22,25)(H,23,24)
InChIKeyJXHZFLRNVLCJFW-UHFFFAOYSA-N
XLogP3.93
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.82
LogP ≤ 53.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide?
The IUPAC name of 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide (CID 170430933) is 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide.
What is the SMILES notation for 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide?
The canonical SMILES for 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide is Cc1cccc(Cl)c1C(=O)NCc1ccc(-c2cccc(=O)[nH]2)cc1.
What is the InChIKey of 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide?
The InChIKey is JXHZFLRNVLCJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN2O2/c1-13-4-2-5-16(21)19(13)20(25)22-12-14-8-10-15(11-9-14)17-6-3-7-18(24)23-17/h2-11H,12H2,1H3,(H,22,25)(H,23,24).
What are the key properties of 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide?
2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide has a molecular weight of 352.82 g/mol, XLogP of 3.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methyl-N-[[4-(6-oxo-1H-pyridin-2-yl)phenyl]methyl]benzamide is sourced from PubChem (CID 170430933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).