2-methyl-N-pyridin-4-ylbenzamide

C13H12N2O — CID 4250390

IUPAC2-methyl-N-pyridin-4-ylbenzamide
SMILESCc1ccccc1C(=O)Nc1ccncc1
InChIInChI=1S/C13H12N2O/c1-10-4-2-3-5-12(10)13(16)15-11-6-8-14-9-7-11/h2-9H,1H3,(H,14,15,16)
InChIKeyIPNZONAZPKLNST-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.64
Rot. Bonds2

About 2-methyl-N-pyridin-4-ylbenzamide

2-methyl-N-pyridin-4-ylbenzamide (PubChem CID 4250390) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is 2-methyl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name2-methyl-N-pyridin-4-ylbenzamide
PubChem CID4250390
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name2-methyl-N-pyridin-4-ylbenzamide
SMILESCc1ccccc1C(=O)Nc1ccncc1
InChIInChI=1S/C13H12N2O/c1-10-4-2-3-5-12(10)13(16)15-11-6-8-14-9-7-11/h2-9H,1H3,(H,14,15,16)
InChIKeyIPNZONAZPKLNST-UHFFFAOYSA-N
XLogP2.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-pyridin-4-ylbenzamide?
The IUPAC name of 2-methyl-N-pyridin-4-ylbenzamide (CID 4250390) is 2-methyl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 2-methyl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 2-methyl-N-pyridin-4-ylbenzamide is Cc1ccccc1C(=O)Nc1ccncc1.
What is the InChIKey of 2-methyl-N-pyridin-4-ylbenzamide?
The InChIKey is IPNZONAZPKLNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c1-10-4-2-3-5-12(10)13(16)15-11-6-8-14-9-7-11/h2-9H,1H3,(H,14,15,16).
What are the key properties of 2-methyl-N-pyridin-4-ylbenzamide?
2-methyl-N-pyridin-4-ylbenzamide has a molecular weight of 212.25 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 4250390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).