N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide

C11H9ClN4O — CID 102979687

IUPACN-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide
SMILESCc1cnc(Cl)c(NC(=O)c2cnccn2)c1
InChIInChI=1S/C11H9ClN4O/c1-7-4-8(10(12)15-5-7)16-11(17)9-6-13-2-3-14-9/h2-6H,1H3,(H,16,17)
InChIKeyOJGAAKIVTIEJGX-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.09
Rot. Bonds2

About N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide

N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide (PubChem CID 102979687) has the molecular formula C11H9ClN4O and a molecular weight of 248.67 g/mol. Its IUPAC name is N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide
PubChem CID102979687
Molecular FormulaC11H9ClN4O
Molecular Weight248.67 g/mol
Exact Mass248.05
IUPAC NameN-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide
SMILESCc1cnc(Cl)c(NC(=O)c2cnccn2)c1
InChIInChI=1S/C11H9ClN4O/c1-7-4-8(10(12)15-5-7)16-11(17)9-6-13-2-3-14-9/h2-6H,1H3,(H,16,17)
InChIKeyOJGAAKIVTIEJGX-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 803312
N-(2,4,5-trimethylphenyl)pyrazine-2-carboxamide
CID 110792925
N-(2-chloro-5-methyl-3-pyridinyl)-2,4,6-trimethylbenzamide
CID 102979790
N-(2-chloro-5-methyl-3-pyridinyl)-6-methylpyridine-2-carboxamide
CID 102979543
N-(4-hydroxy-2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 136762067
2,5-dichloro-N-(2-chloro-5-methyl-3-pyridinyl)thiophene-3-carboxamide
CID 102979594
N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 694797
N-(2-amino-4-chlorophenyl)pyrazine-2-carboxamide
CID 16777409
N-(2-chloro-5-methyl-3-pyridinyl)-3-fluoro-4-methylbenzamide
CID 102979859
N-(2-chloro-5-methyl-3-pyridinyl)-4-cyanobenzamide
CID 102979689
4-amino-N-(2-chloro-5-methyl-3-pyridinyl)-1,2,5-oxadiazole-3-carboxamide
CID 114050962
4-[(2-chloro-5-methyl-3-pyridinyl)carbamoyl]-1H-imidazole-5-carboxylic acid
CID 114050634

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The IUPAC name of N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide (CID 102979687) is N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide is Cc1cnc(Cl)c(NC(=O)c2cnccn2)c1.
What is the InChIKey of N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
The InChIKey is OJGAAKIVTIEJGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN4O/c1-7-4-8(10(12)15-5-7)16-11(17)9-6-13-2-3-14-9/h2-6H,1H3,(H,16,17).
What are the key properties of N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide?
N-(2-chloro-5-methyl-3-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 N-(2-chloro-5-methyl-3-pyridinyl)pyrazine-2-carboxamide is sourced from PubChem (CID 102979687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).