2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide

C15H16N2O — CID 6466927

IUPAC2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCc1ccccc1CC(=O)NCc1cccnc1
InChIInChI=1S/C15H16N2O/c1-12-5-2-3-7-14(12)9-15(18)17-11-13-6-4-8-16-10-13/h2-8,10H,9,11H2,1H3,(H,17,18)
InChIKeyXWOGTNLTMIYPMR-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.25
Rot. Bonds4

About 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide

2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide (PubChem CID 6466927) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide
PubChem CID6466927
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide
SMILESCc1ccccc1CC(=O)NCc1cccnc1
InChIInChI=1S/C15H16N2O/c1-12-5-2-3-7-14(12)9-15(18)17-11-13-6-4-8-16-10-13/h2-8,10H,9,11H2,1H3,(H,17,18)
InChIKeyXWOGTNLTMIYPMR-UHFFFAOYSA-N
XLogP2.25
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide 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-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
The IUPAC name of 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide (CID 6466927) is 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
The canonical SMILES for 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide is Cc1ccccc1CC(=O)NCc1cccnc1.
What is the InChIKey of 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
The InChIKey is XWOGTNLTMIYPMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c1-12-5-2-3-7-14(12)9-15(18)17-11-13-6-4-8-16-10-13/h2-8,10H,9,11H2,1H3,(H,17,18).
What are the key properties of 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide?
2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide has a molecular weight of 240.31 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylphenyl)-N-(pyridin-3-ylmethyl)acetamide is sourced from PubChem (CID 6466927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).