2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide

C20H14N4O — CID 44555104

IUPAC2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide
SMILESO=C(Nc1cnccn1)c1cccc2ccc(-c3ccccc3)nc12
InChIInChI=1S/C20H14N4O/c25-20(24-18-13-21-11-12-22-18)16-8-4-7-15-9-10-17(23-19(15)16)14-5-2-1-3-6-14/h1-13H,(H,22,24,25)
InChIKeyNMBAMGPDDOPDSZ-UHFFFAOYSA-N
MW326.36 g/mol
LogP3.94
Rot. Bonds3

About 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide

2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide (PubChem CID 44555104) has the molecular formula C20H14N4O and a molecular weight of 326.36 g/mol. Its IUPAC name is 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide.

Molecular Properties

Compound Name2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide
PubChem CID44555104
Molecular FormulaC20H14N4O
Molecular Weight326.36 g/mol
Exact Mass326.12
IUPAC Name2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide
SMILESO=C(Nc1cnccn1)c1cccc2ccc(-c3ccccc3)nc12
InChIInChI=1S/C20H14N4O/c25-20(24-18-13-21-11-12-22-18)16-8-4-7-15-9-10-17(23-19(15)16)14-5-2-1-3-6-14/h1-13H,(H,22,24,25)
InChIKeyNMBAMGPDDOPDSZ-UHFFFAOYSA-N
XLogP3.94
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4,6-dimethyl-2-pyridinyl)-2-pyridin-3-ylquinoline-8-carboxamide
CID 58154640
2-bromo-N-pyrazin-2-ylbenzamide
CID 43409356
2-pyridin-3-yl-N-[6-(pyrrolidin-1-ylmethyl)-2-pyridinyl]quinoline-8-carboxamide
CID 58154715
N,2-bis(4-aminophenyl)quinoline-8-carboxamide
CID 162143606
N-[2-[3-(trifluoromethyl)phenyl]quinolin-8-yl]pyrazine-2-carboxamide
CID 44554952
2-bromo-N-pyrazin-2-ylpyridine-3-carboxamide
CID 104853695
2-amino-3-methyl-N-pyrazin-2-ylbenzamide
CID 43616017
[3-[8-(pyrazine-2-carbonylamino)quinolin-2-yl]phenyl] hypofluorite
CID 121354207
N-(2-phenylpyrimidin-5-yl)quinoline-8-carboxamide
CID 134009435
3-fluoro-2-(methylamino)-N-pyrazin-2-ylbenzamide
CID 62661875
N-(2-pyridin-3-ylquinolin-8-yl)-1,3-thiazole-4-carboxamide
CID 44553070
2-piperidin-1-ylsulfonyl-N-pyrazin-2-ylbenzamide
CID 131960359

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide?
The IUPAC name of 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide (CID 44555104) is 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide.
What is the SMILES notation for 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide?
The canonical SMILES for 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide is O=C(Nc1cnccn1)c1cccc2ccc(-c3ccccc3)nc12.
What is the InChIKey of 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide?
The InChIKey is NMBAMGPDDOPDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14N4O/c25-20(24-18-13-21-11-12-22-18)16-8-4-7-15-9-10-17(23-19(15)16)14-5-2-1-3-6-14/h1-13H,(H,22,24,25).
What are the key properties of 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide?
2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide has a molecular weight of 326.36 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-pyrazin-2-ylquinoline-8-carboxamide is sourced from PubChem (CID 44555104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).