3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide

C12H11N3O2 — CID 43616193

IUPAC3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide
SMILESCc1ccc(C(=O)Nc2cnccn2)cc1O
InChIInChI=1S/C12H11N3O2/c1-8-2-3-9(6-10(8)16)12(17)15-11-7-13-4-5-14-11/h2-7,16H,1H3,(H,14,15,17)
InChIKeyXXCSLHNLKFDCJM-UHFFFAOYSA-N
MW229.24 g/mol
LogP1.74
Rot. Bonds2

About 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide

3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide (PubChem CID 43616193) has the molecular formula C12H11N3O2 and a molecular weight of 229.24 g/mol. Its IUPAC name is 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide.

Molecular Properties

Compound Name3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide
PubChem CID43616193
Molecular FormulaC12H11N3O2
Molecular Weight229.24 g/mol
Exact Mass229.09
IUPAC Name3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide
SMILESCc1ccc(C(=O)Nc2cnccn2)cc1O
InChIInChI=1S/C12H11N3O2/c1-8-2-3-9(6-10(8)16)12(17)15-11-7-13-4-5-14-11/h2-7,16H,1H3,(H,14,15,17)
InChIKeyXXCSLHNLKFDCJM-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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Related Compounds

N-(5-chloropyrazin-2-yl)-3-hydroxy-4-methylbenzamide
CID 107595708
4-hydroxy-N-pyrazin-2-ylbenzamide
CID 43422735
N-(5-fluoro-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 65479688
3,5-dihydroxy-N-pyrazin-2-ylbenzamide
CID 107703696
4-amino-N-pyrazin-2-ylbenzamide
CID 43616023
1-methyl-2-oxo-N-pyrazin-2-ylpyridine-4-carboxamide
CID 113221321
6-fluoro-N-pyrazin-2-ylpyridine-3-carboxamide
CID 63971040
3-bromo-5-methyl-N-pyrazin-2-ylbenzamide
CID 104851956
N-pyrazin-2-yl-1H-indazole-6-carboxamide
CID 62907016
N-(5-bromo-6-methyl-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 79048356
N-(6-bromo-2-pyridinyl)-3-hydroxy-4-methylbenzamide
CID 43520349
4-propoxy-N-pyrazin-2-ylbenzamide
CID 71727773

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide?
The IUPAC name of 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide (CID 43616193) is 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide.
What is the SMILES notation for 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide?
The canonical SMILES for 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide is Cc1ccc(C(=O)Nc2cnccn2)cc1O.
What is the InChIKey of 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide?
The InChIKey is XXCSLHNLKFDCJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O2/c1-8-2-3-9(6-10(8)16)12(17)15-11-7-13-4-5-14-11/h2-7,16H,1H3,(H,14,15,17).
What are the key properties of 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide?
3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide 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 3-hydroxy-4-methyl-N-pyrazin-2-ylbenzamide is sourced from PubChem (CID 43616193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).