N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide

C12H11N3O2 — CID 47152291

IUPACN-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ncccc2O)n1
InChIInChI=1S/C12H11N3O2/c1-8-4-2-5-9(14-8)12(17)15-11-10(16)6-3-7-13-11/h2-7,16H,1H3,(H,13,15,17)
InChIKeyKZFYDIJSUPRPPM-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.74
Rot. Bonds2

About N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide

N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide (PubChem CID 47152291) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide
PubChem CID47152291
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC NameN-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide
SMILESCc1cccc(C(=O)Nc2ncccc2O)n1
InChIInChI=1S/C12H11N3O2/c1-8-4-2-5-9(14-8)12(17)15-11-10(16)6-3-7-13-11/h2-7,16H,1H3,(H,13,15,17)
InChIKeyKZFYDIJSUPRPPM-UHFFFAOYSA-N
XLogP1.74
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide (CID 47152291) is N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide is Cc1cccc(C(=O)Nc2ncccc2O)n1.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide?
The InChIKey is KZFYDIJSUPRPPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-8-4-2-5-9(14-8)12(17)15-11-10(16)6-3-7-13-11/h2-7,16H,1H3,(H,13,15,17).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide?
N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide has a molecular weight of 229.24 g/mol, XLogP of 1.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-6-methylpyridine-2-carboxamide is sourced from PubChem (CID 47152291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).