4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one

C15H13FN4O2 — CID 126813091

IUPAC4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCc1cnc2c(c1)NC(=O)CN2C(=O)Cc1ccc(F)cn1
InChIInChI=1S/C15H13FN4O2/c1-9-4-12-15(18-6-9)20(8-13(21)19-12)14(22)5-11-3-2-10(16)7-17-11/h2-4,6-7H,5,8H2,1H3,(H,19,21)
InChIKeyLQNDPOGRXRRXOX-UHFFFAOYSA-N
MW300.29 g/mol
LogP1.45
Rot. Bonds2

About 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one

4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one (PubChem CID 126813091) has the molecular formula C15H13FN4O2 and a molecular weight of 300.29 g/mol. Its IUPAC name is 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one.

Molecular Properties

Compound Name4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
PubChem CID126813091
Molecular FormulaC15H13FN4O2
Molecular Weight300.29 g/mol
Exact Mass300.10
IUPAC Name4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
SMILESCc1cnc2c(c1)NC(=O)CN2C(=O)Cc1ccc(F)cn1
InChIInChI=1S/C15H13FN4O2/c1-9-4-12-15(18-6-9)20(8-13(21)19-12)14(22)5-11-3-2-10(16)7-17-11/h2-4,6-7H,5,8H2,1H3,(H,19,21)
InChIKeyLQNDPOGRXRRXOX-UHFFFAOYSA-N
XLogP1.45
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-chlorophenyl)-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one
CID 79306006
N-[1-[3-fluoro-4-(trifluoromethoxy)phenyl]-2-hydroxy-2-methylpropyl]-7-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
CID 71769070
[2-[1-[(4-fluorophenyl)methyl]-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 4-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-7-carboxylate
CID 166384898
N-[1-[4-(2-fluoropropan-2-yloxy)phenyl]-2-(2-methoxyethoxy)ethyl]-7-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
CID 134332264
1-ethyl-9-[2-(5-fluoro-2-pyridinyl)acetyl]-1,4,9-triazaspiro[5.5]undecan-5-one
CID 131682056
N-[2-(2,4-difluorophenyl)-2,2-difluoroethyl]-4-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-7-carboxamide
CID 167867172
N-[2-[(5-bromo-3-pyridinyl)oxy]-1-[4-(2-fluoropropan-2-yloxy)phenyl]ethyl]-7-methyl-2-oxo-1,3-dihydropyrido[2,3-b]pyrazine-4-carboxamide
CID 134332199
1-ethyl-9-[2-(5-fluoro-2-pyridinyl)acetyl]-1,9-diazaspiro[4.6]undecan-2-one
CID 131684170
2-(5-fluoro-2-pyridinyl)-1-(4-methyl-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-7-yl)ethanone
CID 131683785
4-[2-(4-methylphenyl)acetyl]-1,3-dihydroquinoxalin-2-one
CID 16864023
4-[2-(5-amino-2-pyridinyl)acetyl]-3-methylpiperazine-2,6-dione
CID 107339092
9-[2-(5-fluoro-2-pyridinyl)acetyl]-4,5-dimethyl-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 131683642

Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The IUPAC name of 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one (CID 126813091) is 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one.
What is the SMILES notation for 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The canonical SMILES for 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one is Cc1cnc2c(c1)NC(=O)CN2C(=O)Cc1ccc(F)cn1.
What is the InChIKey of 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
The InChIKey is LQNDPOGRXRRXOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4O2/c1-9-4-12-15(18-6-9)20(8-13(21)19-12)14(22)5-11-3-2-10(16)7-17-11/h2-4,6-7H,5,8H2,1H3,(H,19,21).
What are the key properties of 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one?
4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one has a molecular weight of 300.29 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-fluoro-2-pyridinyl)acetyl]-7-methyl-1,3-dihydropyrido[2,3-b]pyrazin-2-one is sourced from PubChem (CID 126813091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).