6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide

C15H11ClN4O — CID 103337437

IUPAC6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide
SMILESCc1ccc2cccc(NC(=O)c3cncc(Cl)n3)c2n1
InChIInChI=1S/C15H11ClN4O/c1-9-5-6-10-3-2-4-11(14(10)18-9)20-15(21)12-7-17-8-13(16)19-12/h2-8H,1H3,(H,20,21)
InChIKeyNVKPZLBYTSYDIW-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.24
Rot. Bonds2

About 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide

6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide (PubChem CID 103337437) has the molecular formula C15H11ClN4O and a molecular weight of 298.73 g/mol. Its IUPAC name is 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide
PubChem CID103337437
Molecular FormulaC15H11ClN4O
Molecular Weight298.73 g/mol
Exact Mass298.06
IUPAC Name6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide
SMILESCc1ccc2cccc(NC(=O)c3cncc(Cl)n3)c2n1
InChIInChI=1S/C15H11ClN4O/c1-9-5-6-10-3-2-4-11(14(10)18-9)20-15(21)12-7-17-8-13(16)19-12/h2-8H,1H3,(H,20,21)
InChIKeyNVKPZLBYTSYDIW-UHFFFAOYSA-N
XLogP3.24
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-quinolin-8-ylpyrazine-2-carboxamide
CID 103186933
3-chloro-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
CID 66482984
5-bromo-N-(2-methylquinolin-8-yl)pyridine-3-carboxamide
CID 62954817
6-chloro-N-(3-fluoro-2-methylphenyl)pyrazine-2-carboxamide
CID 103337581
3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
CID 81440113
2-hydroxy-N-(2-methylquinolin-8-yl)benzamide
CID 62954992
6-amino-N-(2-methylquinolin-8-yl)pyridine-3-carboxamide
CID 62953787
2-(aminomethyl)-N-(2-methylquinolin-8-yl)-1,3-thiazole-4-carboxamide
CID 66379840
N-(2-methylquinolin-8-yl)pyrene-1-carboxamide
CID 168859940
4-bromo-N-(2-methylquinolin-8-yl)-1H-pyrrole-2-carboxamide
CID 62954640
3-chloro-N-(2-methylquinolin-8-yl)-1-benzothiophene-2-carboxamide
CID 1012016
methyl 2-[(2-methylquinolin-8-yl)amino]-2-oxoacetate
CID 112617186

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide?
The IUPAC name of 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide (CID 103337437) is 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide is Cc1ccc2cccc(NC(=O)c3cncc(Cl)n3)c2n1.
What is the InChIKey of 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide?
The InChIKey is NVKPZLBYTSYDIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN4O/c1-9-5-6-10-3-2-4-11(14(10)18-9)20-15(21)12-7-17-8-13(16)19-12/h2-8H,1H3,(H,20,21).
What are the key properties of 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide?
6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide has a molecular weight of 298.73 g/mol, XLogP of 3.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methylquinolin-8-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 103337437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).