4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one

C24H16FN3O — CID 118940815

IUPAC4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one
SMILESO=c1cnc2cccnc2n1Cc1ccc(-c2ccc3ccccc3c2)cc1F
InChIInChI=1S/C24H16FN3O/c25-21-13-19(18-8-7-16-4-1-2-5-17(16)12-18)9-10-20(21)15-28-23(29)14-27-22-6-3-11-26-24(22)28/h1-14H,15H2
InChIKeyBRVDIXONEKVKAG-UHFFFAOYSA-N
MW381.41 g/mol
LogP4.80
Rot. Bonds3

About 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one

4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one (PubChem CID 118940815) has the molecular formula C24H16FN3O and a molecular weight of 381.41 g/mol. Its IUPAC name is 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one.

Molecular Properties

Compound Name4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one
PubChem CID118940815
Molecular FormulaC24H16FN3O
Molecular Weight381.41 g/mol
Exact Mass381.13
IUPAC Name4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one
SMILESO=c1cnc2cccnc2n1Cc1ccc(-c2ccc3ccccc3c2)cc1F
InChIInChI=1S/C24H16FN3O/c25-21-13-19(18-8-7-16-4-1-2-5-17(16)12-18)9-10-20(21)15-28-23(29)14-27-22-6-3-11-26-24(22)28/h1-14H,15H2
InChIKeyBRVDIXONEKVKAG-UHFFFAOYSA-N
XLogP4.80
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.41
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[4-[5,6-bis(ethenyl)-3-pyridinyl]-2-fluorophenyl]methyl]pyrido[2,3-b]pyrazin-3-one
CID 144741976
4-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-3-one
CID 159983684
3-[4-(5,7-dihydropyrrolo[3,4-b]pyridin-6-ylmethyl)-3-fluorophenyl]quinoline
CID 129019231
1-[(2-fluoro-4-indolizin-6-ylphenyl)methyl]pyrido[2,3-b]pyrazin-2-one
CID 118940896
1-[[2-fluoro-4-(1H-inden-5-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-2-one
CID 118940895
4-[(2-fluoro-4-indolizin-6-ylphenyl)methyl]pyrido[3,4-b]pyrazin-3-one
CID 118940830
1-[(3-naphthalen-2-ylphenyl)methyl]pyrido[3,4-b]pyrazin-2-one
CID 118940872
4-[(3-naphthalen-2-ylphenyl)methyl]pyrido[3,4-b]pyrazin-3-one
CID 118940844
1-[[2-(aminomethyl)-5-fluorophenyl]methyl]quinoxalin-2-one
CID 64765379
1-[[2-(aminomethyl)-3-pyridinyl]methyl]quinoxalin-2-one
CID 62893313
1-[[2,6-difluoro-4-(1H-indazol-6-yl)phenyl]methyl]quinoxalin-2-one;molecular hydrogen
CID 144741980
4-[[3-(7H-cyclopenta[b]pyridin-3-yl)phenyl]methyl]pyrido[2,3-b]pyrazin-3-one
CID 158545035

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one?
The IUPAC name of 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one (CID 118940815) is 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one.
What is the SMILES notation for 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one?
The canonical SMILES for 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one is O=c1cnc2cccnc2n1Cc1ccc(-c2ccc3ccccc3c2)cc1F.
What is the InChIKey of 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one?
The InChIKey is BRVDIXONEKVKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN3O/c25-21-13-19(18-8-7-16-4-1-2-5-17(16)12-18)9-10-20(21)15-28-23(29)14-27-22-6-3-11-26-24(22)28/h1-14H,15H2.
What are the key properties of 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one?
4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one has a molecular weight of 381.41 g/mol, XLogP of 4.80, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluoro-4-naphthalen-2-ylphenyl)methyl]pyrido[2,3-b]pyrazin-3-one is sourced from PubChem (CID 118940815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).