4-methoxy-N-pyridin-2-ylbenzamide

C13H12N2O2 — CID 821599

IUPAC4-methoxy-N-pyridin-2-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C13H12N2O2/c1-17-11-7-5-10(6-8-11)13(16)15-12-4-2-3-9-14-12/h2-9H,1H3,(H,14,15,16)
InChIKeyYFXWAMDABVLKSA-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.34
Rot. Bonds3

About 4-methoxy-N-pyridin-2-ylbenzamide

4-methoxy-N-pyridin-2-ylbenzamide (PubChem CID 821599) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is 4-methoxy-N-pyridin-2-ylbenzamide.

Molecular Properties

Compound Name4-methoxy-N-pyridin-2-ylbenzamide
PubChem CID821599
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC Name4-methoxy-N-pyridin-2-ylbenzamide
SMILESCOc1ccc(C(=O)Nc2ccccn2)cc1
InChIInChI=1S/C13H12N2O2/c1-17-11-7-5-10(6-8-11)13(16)15-12-4-2-3-9-14-12/h2-9H,1H3,(H,14,15,16)
InChIKeyYFXWAMDABVLKSA-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 4-methoxy-N-pyridin-2-ylbenzamide?
The IUPAC name of 4-methoxy-N-pyridin-2-ylbenzamide (CID 821599) is 4-methoxy-N-pyridin-2-ylbenzamide.
What is the SMILES notation for 4-methoxy-N-pyridin-2-ylbenzamide?
The canonical SMILES for 4-methoxy-N-pyridin-2-ylbenzamide is COc1ccc(C(=O)Nc2ccccn2)cc1.
What is the InChIKey of 4-methoxy-N-pyridin-2-ylbenzamide?
The InChIKey is YFXWAMDABVLKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c1-17-11-7-5-10(6-8-11)13(16)15-12-4-2-3-9-14-12/h2-9H,1H3,(H,14,15,16).
What are the key properties of 4-methoxy-N-pyridin-2-ylbenzamide?
4-methoxy-N-pyridin-2-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 4-methoxy-N-pyridin-2-ylbenzamide is sourced from PubChem (CID 821599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).