2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one

C19H12ClN3O — CID 154657088

IUPAC2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESO=c1cc[nH]c2nc(-c3ccccc3)c(-c3cccc(Cl)c3)nc12
InChIInChI=1S/C19H12ClN3O/c20-14-8-4-7-13(11-14)17-16(12-5-2-1-3-6-12)23-19-18(22-17)15(24)9-10-21-19/h1-11H,(H,21,23,24)
InChIKeyKQUPEIHXYHHOHH-UHFFFAOYSA-N
MW333.78 g/mol
LogP4.31
Rot. Bonds2

About 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one

2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one (PubChem CID 154657088) has the molecular formula C19H12ClN3O and a molecular weight of 333.78 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
PubChem CID154657088
Molecular FormulaC19H12ClN3O
Molecular Weight333.78 g/mol
Exact Mass333.07
IUPAC Name2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESO=c1cc[nH]c2nc(-c3ccccc3)c(-c3cccc(Cl)c3)nc12
InChIInChI=1S/C19H12ClN3O/c20-14-8-4-7-13(11-14)17-16(12-5-2-1-3-6-12)23-19-18(22-17)15(24)9-10-21-19/h1-11H,(H,21,23,24)
InChIKeyKQUPEIHXYHHOHH-UHFFFAOYSA-N
XLogP4.31
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.78
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 137423280
2-(5-chloro-1-cyclopropyl-6-oxo-3-pyridinyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656659
2-(2-methoxy-4-pyridinyl)-3-[3-(trifluoromethyl)phenyl]-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657626
3-[2-(1,3-benzothiazol-6-yl)-8-oxo-5H-pyrido[2,3-b]pyrazin-3-yl]benzonitrile
CID 154657223
4-(3-chlorophenyl)-7H-pyrrolo[2,3-d]pyrimidine
CID 74221294
2-(2-chloro-6-methyl-4-pyridinyl)-3-(5-methyl-1,3,4-oxadiazol-2-yl)-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657052
3-(4-fluorophenyl)-2-(3-fluoro-4-pyridinyl)-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657211
2-(3-chlorophenyl)-1H-pyridin-4-one
CID 53229265
6-(5-chloro-4-oxocyclohexa-1,5-dien-1-yl)-7-phenyl-1H-1,8-naphthyridin-4-one
CID 160918022
7-bromo-2-(8-chloroquinolin-6-yl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154656457
5-(3-chlorophenyl)-1-hydroxy-3-phenylpyrazin-2-one
CID 1486226
4-(3-chlorophenyl)-5-methyl-2-phenyl-1H-pyrimidin-6-one
CID 135453967

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The IUPAC name of 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one (CID 154657088) is 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one.
What is the SMILES notation for 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The canonical SMILES for 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one is O=c1cc[nH]c2nc(-c3ccccc3)c(-c3cccc(Cl)c3)nc12.
What is the InChIKey of 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
The InChIKey is KQUPEIHXYHHOHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClN3O/c20-14-8-4-7-13(11-14)17-16(12-5-2-1-3-6-12)23-19-18(22-17)15(24)9-10-21-19/h1-11H,(H,21,23,24).
What are the key properties of 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one?
2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one has a molecular weight of 333.78 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-3-phenyl-5H-pyrido[2,3-b]pyrazin-8-one is sourced from PubChem (CID 154657088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).