3-acetamido-N-(pyridin-2-ylmethyl)benzamide

C15H15N3O2 — CID 13177095

IUPAC3-acetamido-N-(pyridin-2-ylmethyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCc2ccccn2)c1
InChIInChI=1S/C15H15N3O2/c1-11(19)18-13-7-4-5-12(9-13)15(20)17-10-14-6-2-3-8-16-14/h2-9H,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyGEHXXZHUYANUNF-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.97
Rot. Bonds4

About 3-acetamido-N-(pyridin-2-ylmethyl)benzamide

3-acetamido-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 13177095) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 3-acetamido-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name3-acetamido-N-(pyridin-2-ylmethyl)benzamide
PubChem CID13177095
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name3-acetamido-N-(pyridin-2-ylmethyl)benzamide
SMILESCC(=O)Nc1cccc(C(=O)NCc2ccccn2)c1
InChIInChI=1S/C15H15N3O2/c1-11(19)18-13-7-4-5-12(9-13)15(20)17-10-14-6-2-3-8-16-14/h2-9H,10H2,1H3,(H,17,20)(H,18,19)
InChIKeyGEHXXZHUYANUNF-UHFFFAOYSA-N
XLogP1.97
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-diacetamido-N-(pyridin-2-ylmethyl)benzamide
CID 18107560
N-(pyridin-2-ylmethyl)-3-(pyrimidin-2-ylamino)benzamide
CID 31860864
3-(cyclopropylcarbamoylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 47041310
N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 17297031
1-N-(pyridin-2-ylmethyl)-3-N-sulfanylbenzene-1,3-dicarboxamide
CID 143484238
6-(diethylamino)-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]pyridine-3-carboxamide
CID 48659585
3-phenyl-N-(pyridin-2-ylmethyl)benzamide
CID 110724423
2,5-dimethoxy-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]benzamide
CID 55783848
3-[[2-(3,4-dimethylphenoxy)acetyl]amino]-N-(pyridin-2-ylmethyl)benzamide
CID 55783941
2-(4-fluorobenzoyl)-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]benzamide
CID 60555105
2-chloro-4-fluoro-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]benzamide
CID 55783783
3-[3-(4-tert-butylphenyl)prop-2-enoylamino]-N-(pyridin-2-ylmethyl)benzamide
CID 55782478

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 3-acetamido-N-(pyridin-2-ylmethyl)benzamide (CID 13177095) is 3-acetamido-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 3-acetamido-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 3-acetamido-N-(pyridin-2-ylmethyl)benzamide is CC(=O)Nc1cccc(C(=O)NCc2ccccn2)c1.
What is the InChIKey of 3-acetamido-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is GEHXXZHUYANUNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-11(19)18-13-7-4-5-12(9-13)15(20)17-10-14-6-2-3-8-16-14/h2-9H,10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of 3-acetamido-N-(pyridin-2-ylmethyl)benzamide?
3-acetamido-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 269.30 g/mol, XLogP of 1.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 13177095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).