2-(3-methylphenyl)-N-pyridin-3-ylacetamide

C14H14N2O — CID 6467227

IUPAC2-(3-methylphenyl)-N-pyridin-3-ylacetamide
SMILESCc1cccc(CC(=O)Nc2cccnc2)c1
InChIInChI=1S/C14H14N2O/c1-11-4-2-5-12(8-11)9-14(17)16-13-6-3-7-15-10-13/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyAHPALPGTXJXWGY-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.57
Rot. Bonds3

About 2-(3-methylphenyl)-N-pyridin-3-ylacetamide

2-(3-methylphenyl)-N-pyridin-3-ylacetamide (PubChem CID 6467227) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(3-methylphenyl)-N-pyridin-3-ylacetamide.

Molecular Properties

Compound Name2-(3-methylphenyl)-N-pyridin-3-ylacetamide
PubChem CID6467227
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name2-(3-methylphenyl)-N-pyridin-3-ylacetamide
SMILESCc1cccc(CC(=O)Nc2cccnc2)c1
InChIInChI=1S/C14H14N2O/c1-11-4-2-5-12(8-11)9-14(17)16-13-6-3-7-15-10-13/h2-8,10H,9H2,1H3,(H,16,17)
InChIKeyAHPALPGTXJXWGY-UHFFFAOYSA-N
XLogP2.57
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methylphenyl)-N-pyridin-3-ylacetamide?
The IUPAC name of 2-(3-methylphenyl)-N-pyridin-3-ylacetamide (CID 6467227) is 2-(3-methylphenyl)-N-pyridin-3-ylacetamide.
What is the SMILES notation for 2-(3-methylphenyl)-N-pyridin-3-ylacetamide?
The canonical SMILES for 2-(3-methylphenyl)-N-pyridin-3-ylacetamide is Cc1cccc(CC(=O)Nc2cccnc2)c1.
What is the InChIKey of 2-(3-methylphenyl)-N-pyridin-3-ylacetamide?
The InChIKey is AHPALPGTXJXWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-11-4-2-5-12(8-11)9-14(17)16-13-6-3-7-15-10-13/h2-8,10H,9H2,1H3,(H,16,17).
What are the key properties of 2-(3-methylphenyl)-N-pyridin-3-ylacetamide?
2-(3-methylphenyl)-N-pyridin-3-ylacetamide has a molecular weight of 226.28 g/mol, XLogP of 2.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylphenyl)-N-pyridin-3-ylacetamide is sourced from PubChem (CID 6467227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).