4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide

C15H10FN3O2 — CID 763006

IUPAC4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
SMILESO=C(Nc1cnc2ccccn2c1=O)c1ccc(F)cc1
InChIInChI=1S/C15H10FN3O2/c16-11-6-4-10(5-7-11)14(20)18-12-9-17-13-3-1-2-8-19(13)15(12)21/h1-9H,(H,18,20)
InChIKeyWEJWDNITQJITJI-UHFFFAOYSA-N
MW283.26 g/mol
LogP2.09
Rot. Bonds2

About 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide

4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide (PubChem CID 763006) has the molecular formula C15H10FN3O2 and a molecular weight of 283.26 g/mol. Its IUPAC name is 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
PubChem CID763006
Molecular FormulaC15H10FN3O2
Molecular Weight283.26 g/mol
Exact Mass283.08
IUPAC Name4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
SMILESO=C(Nc1cnc2ccccn2c1=O)c1ccc(F)cc1
InChIInChI=1S/C15H10FN3O2/c16-11-6-4-10(5-7-11)14(20)18-12-9-17-13-3-1-2-8-19(13)15(12)21/h1-9H,(H,18,20)
InChIKeyWEJWDNITQJITJI-UHFFFAOYSA-N
XLogP2.09
TPSA63.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-tert-butyl-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide
CID 6457996
N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)pyrazine-2-carboxamide
CID 15372135
4-oxo-4-[(4-oxopyrido[1,2-a]pyrimidin-3-yl)amino]butanoic acid
CID 44782792
3-benzamido-N-[(4-fluorophenyl)methyl]-4-oxopyrido[1,2-a]pyrimidine-9-carboxamide
CID 44783045
4-fluoro-N-[9-(morpholine-4-carbonyl)-4-oxopyrido[1,2-a]pyrimidin-3-yl]benzamide
CID 44782939
1-cyclohexyl-3-(4-oxopyrido[1,2-a]pyrimidin-3-yl)urea
CID 44782767
N-(4-chloro-2-fluorophenyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 24672239
3-(2-methylpropyl)-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176504414
N-[4-(4-fluorophenoxy)butyl]-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 51329870
N-(2-chlorophenyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 4572245
N-(2-fluoro-5-methylphenyl)-4-oxopyrido[1,2-a]pyrimidine-3-carboxamide
CID 51335432
4-methyl-N-(4-oxopyrimido[1,2-a]pyrimidin-3-yl)benzamide
CID 18891669

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
The IUPAC name of 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide (CID 763006) is 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide.
What is the SMILES notation for 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
The canonical SMILES for 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide is O=C(Nc1cnc2ccccn2c1=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
The InChIKey is WEJWDNITQJITJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FN3O2/c16-11-6-4-10(5-7-11)14(20)18-12-9-17-13-3-1-2-8-19(13)15(12)21/h1-9H,(H,18,20).
What are the key properties of 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide?
4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide has a molecular weight of 283.26 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(4-oxopyrido[1,2-a]pyrimidin-3-yl)benzamide is sourced from PubChem (CID 763006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).