N-(3-methylphenyl)pyrazine-2-carboxamide

C12H11N3O — CID 743190

IUPACN-(3-methylphenyl)pyrazine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cnccn2)c1
InChIInChI=1S/C12H11N3O/c1-9-3-2-4-10(7-9)15-12(16)11-8-13-5-6-14-11/h2-8H,1H3,(H,15,16)
InChIKeyASWRZMFQNLKJSF-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.04
Rot. Bonds2

About N-(3-methylphenyl)pyrazine-2-carboxamide

N-(3-methylphenyl)pyrazine-2-carboxamide (PubChem CID 743190) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is N-(3-methylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylphenyl)pyrazine-2-carboxamide
PubChem CID743190
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC NameN-(3-methylphenyl)pyrazine-2-carboxamide
SMILESCc1cccc(NC(=O)c2cnccn2)c1
InChIInChI=1S/C12H11N3O/c1-9-3-2-4-10(7-9)15-12(16)11-8-13-5-6-14-11/h2-8H,1H3,(H,15,16)
InChIKeyASWRZMFQNLKJSF-UHFFFAOYSA-N
XLogP2.04
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methylphenyl)pyrazine-2-carboxamide?
The IUPAC name of N-(3-methylphenyl)pyrazine-2-carboxamide (CID 743190) is N-(3-methylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3-methylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(3-methylphenyl)pyrazine-2-carboxamide is Cc1cccc(NC(=O)c2cnccn2)c1.
What is the InChIKey of N-(3-methylphenyl)pyrazine-2-carboxamide?
The InChIKey is ASWRZMFQNLKJSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-9-3-2-4-10(7-9)15-12(16)11-8-13-5-6-14-11/h2-8H,1H3,(H,15,16).
What are the key properties of N-(3-methylphenyl)pyrazine-2-carboxamide?
N-(3-methylphenyl)pyrazine-2-carboxamide has a molecular weight of 213.24 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 743190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).