N-(2,3-dimethylphenyl)pyrazine-2-carboxamide

C13H13N3O — CID 694797

IUPACN-(2,3-dimethylphenyl)pyrazine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cnccn2)c1C
InChIInChI=1S/C13H13N3O/c1-9-4-3-5-11(10(9)2)16-13(17)12-8-14-6-7-15-12/h3-8H,1-2H3,(H,16,17)
InChIKeyONQJXYOKWJITMO-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.35
Rot. Bonds2

About N-(2,3-dimethylphenyl)pyrazine-2-carboxamide

N-(2,3-dimethylphenyl)pyrazine-2-carboxamide (PubChem CID 694797) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)pyrazine-2-carboxamide
PubChem CID694797
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC NameN-(2,3-dimethylphenyl)pyrazine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cnccn2)c1C
InChIInChI=1S/C13H13N3O/c1-9-4-3-5-11(10(9)2)16-13(17)12-8-14-6-7-15-12/h3-8H,1-2H3,(H,16,17)
InChIKeyONQJXYOKWJITMO-UHFFFAOYSA-N
XLogP2.35
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylphenyl)-5-methylpyrazine-2-carboxamide
CID 16613943
N-[2-methyl-3-(propan-2-ylsulfanylmethyl)phenyl]pyrazine-2-carboxamide
CID 71999234
3-chloro-N-(2,3-dimethylphenyl)pyridine-4-carboxamide
CID 66462249
4-amino-N-(2,3-dimethylphenyl)pyridine-2-carboxamide
CID 62156095
N-(2-sulfanylphenyl)pyrazine-2-carboxamide
CID 136757506
N-(2,4,5-trimethylphenyl)pyrazine-2-carboxamide
CID 110792925
N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 803312
N-quinolin-8-ylpyrazine-2-carboxamide
CID 139088852
N-(2-benzylphenyl)pyrazine-2-carboxamide
CID 1247505
N-(1-methylbenzimidazol-4-yl)pyrazine-2-carboxamide
CID 175533892
2-N-(2,3-dimethylphenyl)-4-N-(2,6-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092030
N-(4-hydroxy-2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 136762067

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)pyrazine-2-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)pyrazine-2-carboxamide (CID 694797) is N-(2,3-dimethylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)pyrazine-2-carboxamide is Cc1cccc(NC(=O)c2cnccn2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)pyrazine-2-carboxamide?
The InChIKey is ONQJXYOKWJITMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-9-4-3-5-11(10(9)2)16-13(17)12-8-14-6-7-15-12/h3-8H,1-2H3,(H,16,17).
What are the key properties of N-(2,3-dimethylphenyl)pyrazine-2-carboxamide?
N-(2,3-dimethylphenyl)pyrazine-2-carboxamide has a molecular weight of 227.27 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 694797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).