N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide

C12H11N3O3 — CID 75454195

IUPACN-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)[nH]cc1C(=O)Nc1ncccc1O
InChIInChI=1S/C12H11N3O3/c1-7-5-10(17)14-6-8(7)12(18)15-11-9(16)3-2-4-13-11/h2-6,16H,1H3,(H,14,17)(H,13,15,18)
InChIKeyLVRVNFXQRGUVND-UHFFFAOYSA-N
MW245.24 g/mol
LogP1.04
Rot. Bonds2

About N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide

N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 75454195) has the molecular formula C12H11N3O3 and a molecular weight of 245.24 g/mol. Its IUPAC name is N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide
PubChem CID75454195
Molecular FormulaC12H11N3O3
Molecular Weight245.24 g/mol
Exact Mass245.08
IUPAC NameN-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)[nH]cc1C(=O)Nc1ncccc1O
InChIInChI=1S/C12H11N3O3/c1-7-5-10(17)14-6-8(7)12(18)15-11-9(16)3-2-4-13-11/h2-6,16H,1H3,(H,14,17)(H,13,15,18)
InChIKeyLVRVNFXQRGUVND-UHFFFAOYSA-N
XLogP1.04
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.24
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide (CID 75454195) is N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide is Cc1cc(=O)[nH]cc1C(=O)Nc1ncccc1O.
What is the InChIKey of N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LVRVNFXQRGUVND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O3/c1-7-5-10(17)14-6-8(7)12(18)15-11-9(16)3-2-4-13-11/h2-6,16H,1H3,(H,14,17)(H,13,15,18).
What are the key properties of N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide?
N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 245.24 g/mol, XLogP of 1.04, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-pyridinyl)-4-methyl-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75454195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).