N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide

C13H12N2O2 — CID 110462446

IUPACN-(3-hydroxy-2-pyridinyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1ncccc1O
InChIInChI=1S/C13H12N2O2/c1-9-5-2-3-6-10(9)13(17)15-12-11(16)7-4-8-14-12/h2-8,16H,1H3,(H,14,15,17)
InChIKeyXSNKJRCVXOITFM-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.35
Rot. Bonds2

About N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide

N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide (PubChem CID 110462446) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-2-methylbenzamide
PubChem CID110462446
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC NameN-(3-hydroxy-2-pyridinyl)-2-methylbenzamide
SMILESCc1ccccc1C(=O)Nc1ncccc1O
InChIInChI=1S/C13H12N2O2/c1-9-5-2-3-6-10(9)13(17)15-12-11(16)7-4-8-14-12/h2-8,16H,1H3,(H,14,15,17)
InChIKeyXSNKJRCVXOITFM-UHFFFAOYSA-N
XLogP2.35
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide (CID 110462446) is N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide is Cc1ccccc1C(=O)Nc1ncccc1O.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide?
The InChIKey is XSNKJRCVXOITFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c1-9-5-2-3-6-10(9)13(17)15-12-11(16)7-4-8-14-12/h2-8,16H,1H3,(H,14,15,17).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide?
N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide has a molecular weight of 228.25 g/mol, XLogP of 2.35, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-2-methylbenzamide is sourced from PubChem (CID 110462446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).