3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide

C15H12N4O — CID 174819782

IUPAC3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide
SMILESNC(=O)c1nccnc1Cc1cnc2ccccc2c1
InChIInChI=1S/C15H12N4O/c16-15(20)14-13(17-5-6-18-14)8-10-7-11-3-1-2-4-12(11)19-9-10/h1-7,9H,8H2,(H2,16,20)
InChIKeyKNAWXGXQZVQHPJ-UHFFFAOYSA-N
MW264.29 g/mol
LogP1.71
Rot. Bonds3

About 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide

3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide (PubChem CID 174819782) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide
PubChem CID174819782
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide
SMILESNC(=O)c1nccnc1Cc1cnc2ccccc2c1
InChIInChI=1S/C15H12N4O/c16-15(20)14-13(17-5-6-18-14)8-10-7-11-3-1-2-4-12(11)19-9-10/h1-7,9H,8H2,(H2,16,20)
InChIKeyKNAWXGXQZVQHPJ-UHFFFAOYSA-N
XLogP1.71
TPSA81.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

quinolin-3-ylmethyl acetate
CID 101032812
quinoline-3-carboxamide;hydrofluoride
CID 174911514
2-quinolin-3-ylethanol
CID 53403774
3-[(4-bromophenyl)methyl]quinoline
CID 67155836
3-[[4-(trifluoromethyl)phenyl]methyl]quinoline
CID 154466638
2-methyl-N-(quinolin-3-ylmethyl)propanamide
CID 110733747
3-(2,2,2-trifluoroethyl)quinoline
CID 102230069
2-quinolin-3-ylethanamine;hydrochloride
CID 68724239
(2S)-2-amino-3-(quinolin-3-ylmethylsulfanyl)propanoic acid
CID 114203513
3-[(2-methoxyphenyl)methyl]pyrazine-2-carboxamide
CID 146380303
4-(quinolin-3-ylmethyl)-5,6,7,8-tetrahydro-2H-phthalazin-1-one
CID 66966171
quinolin-3-ylmethyl 4-(4-hydroxyphenyl)benzoate
CID 10832034

Frequently Asked Questions

What is the IUPAC name of 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide?
The IUPAC name of 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide (CID 174819782) is 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide?
The canonical SMILES for 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide is NC(=O)c1nccnc1Cc1cnc2ccccc2c1.
What is the InChIKey of 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide?
The InChIKey is KNAWXGXQZVQHPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c16-15(20)14-13(17-5-6-18-14)8-10-7-11-3-1-2-4-12(11)19-9-10/h1-7,9H,8H2,(H2,16,20).
What are the key properties of 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide?
3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide has a molecular weight of 264.29 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(quinolin-3-ylmethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 174819782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).