6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide

C11H9ClN4O — CID 103186850

IUPAC6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cncc(Cl)n2)nc1
InChIInChI=1S/C11H9ClN4O/c1-7-2-3-10(14-4-7)16-11(17)8-5-13-6-9(12)15-8/h2-6H,1H3,(H,14,16,17)
InChIKeyAMRDWHPCVIIKKB-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.09
Rot. Bonds2

About 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide

6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide (PubChem CID 103186850) has the molecular formula C11H9ClN4O and a molecular weight of 248.67 g/mol. Its IUPAC name is 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide
PubChem CID103186850
Molecular FormulaC11H9ClN4O
Molecular Weight248.67 g/mol
Exact Mass248.05
IUPAC Name6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide
SMILESCc1ccc(NC(=O)c2cncc(Cl)n2)nc1
InChIInChI=1S/C11H9ClN4O/c1-7-2-3-10(14-4-7)16-11(17)8-5-13-6-9(12)15-8/h2-6H,1H3,(H,14,16,17)
InChIKeyAMRDWHPCVIIKKB-UHFFFAOYSA-N
XLogP2.09
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide?
The IUPAC name of 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide (CID 103186850) is 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide is Cc1ccc(NC(=O)c2cncc(Cl)n2)nc1.
What is the InChIKey of 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide?
The InChIKey is AMRDWHPCVIIKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN4O/c1-7-2-3-10(14-4-7)16-11(17)8-5-13-6-9(12)15-8/h2-6H,1H3,(H,14,16,17).
What are the key properties of 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide?
6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide has a molecular weight of 248.67 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(5-methyl-2-pyridinyl)pyrazine-2-carboxamide is sourced from PubChem (CID 103186850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).