2-methoxy-N-pyridin-3-ylbenzamide

C13H12N2O2 — CID 676042

IUPAC2-methoxy-N-pyridin-3-ylbenzamide
SMILESCOc1ccccc1C(=O)Nc1cccnc1
InChIInChI=1S/C13H12N2O2/c1-17-12-7-3-2-6-11(12)13(16)15-10-5-4-8-14-9-10/h2-9H,1H3,(H,15,16)
InChIKeyOQVYNPXHJJKJCS-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.34
Rot. Bonds3

About 2-methoxy-N-pyridin-3-ylbenzamide

2-methoxy-N-pyridin-3-ylbenzamide (PubChem CID 676042) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is 2-methoxy-N-pyridin-3-ylbenzamide.

Molecular Properties

Compound Name2-methoxy-N-pyridin-3-ylbenzamide
PubChem CID676042
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC Name2-methoxy-N-pyridin-3-ylbenzamide
SMILESCOc1ccccc1C(=O)Nc1cccnc1
InChIInChI=1S/C13H12N2O2/c1-17-12-7-3-2-6-11(12)13(16)15-10-5-4-8-14-9-10/h2-9H,1H3,(H,15,16)
InChIKeyOQVYNPXHJJKJCS-UHFFFAOYSA-N
XLogP2.34
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-pyridin-3-ylbenzamide?
The IUPAC name of 2-methoxy-N-pyridin-3-ylbenzamide (CID 676042) is 2-methoxy-N-pyridin-3-ylbenzamide.
What is the SMILES notation for 2-methoxy-N-pyridin-3-ylbenzamide?
The canonical SMILES for 2-methoxy-N-pyridin-3-ylbenzamide is COc1ccccc1C(=O)Nc1cccnc1.
What is the InChIKey of 2-methoxy-N-pyridin-3-ylbenzamide?
The InChIKey is OQVYNPXHJJKJCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c1-17-12-7-3-2-6-11(12)13(16)15-10-5-4-8-14-9-10/h2-9H,1H3,(H,15,16).
What are the key properties of 2-methoxy-N-pyridin-3-ylbenzamide?
2-methoxy-N-pyridin-3-ylbenzamide has a molecular weight of 228.25 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-pyridin-3-ylbenzamide is sourced from PubChem (CID 676042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).