2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one

C8H6FN3O — CID 115015289

IUPAC2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one
SMILESNc1cc(=O)n2ccc(F)cc2n1
InChIInChI=1S/C8H6FN3O/c9-5-1-2-12-7(3-5)11-6(10)4-8(12)13/h1-4H,10H2
InChIKeyFKBKWGBNKPYMHF-UHFFFAOYSA-N
MW179.15 g/mol
LogP0.42
Rot. Bonds

About 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one

2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one (PubChem CID 115015289) has the molecular formula C8H6FN3O and a molecular weight of 179.15 g/mol. Its IUPAC name is 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one
PubChem CID115015289
Molecular FormulaC8H6FN3O
Molecular Weight179.15 g/mol
Exact Mass179.05
IUPAC Name2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one
SMILESNc1cc(=O)n2ccc(F)cc2n1
InChIInChI=1S/C8H6FN3O/c9-5-1-2-12-7(3-5)11-6(10)4-8(12)13/h1-4H,10H2
InChIKeyFKBKWGBNKPYMHF-UHFFFAOYSA-N
XLogP0.42
TPSA60.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.15
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-chloro-4H-pyrido(1,2-a)pyrimidin-4-one
CID 94959
4H-Pyrido[1,2-a]pyrimidin-4-one
CID 354785
2-Hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one
CID 135413477
2,7-dichloro-4H-pyrido(1,2-a)pyrimidin-4-one
CID 7131618
2-Methyl-4H-pyrido(1,2-a)pyrimidin-4-one
CID 278093
2H-pyrido[1,2-a]pyrimidin-2-one
CID 423945
2-(aminomethyl)-4H-pyrido[1,2-a]pyrimidin-4-one
CID 47003241
8-Bromo-4H-pyrido(1,2-a)pyrimidin-4-one
CID 83892083
7-fluoro-2-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one
CID 136629818
9-Fluoro-2,3-dihydro-4h-pyrido[1,2-a]pyrimidin-4-one
CID 129892468
7-Fluoro-2,3-dihydro-4h-pyrido[1,2-a]pyrimidin-4-one
CID 129892490
3-Amino-4H-pyrido[1,2-a]pyrimidin-4-one
CID 3514055

Frequently Asked Questions

What is the IUPAC name of 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one (CID 115015289) is 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one is Nc1cc(=O)n2ccc(F)cc2n1.
What is the InChIKey of 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one?
The InChIKey is FKBKWGBNKPYMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN3O/c9-5-1-2-12-7(3-5)11-6(10)4-8(12)13/h1-4H,10H2.
What are the key properties of 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one?
2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one has a molecular weight of 179.15 g/mol, XLogP of 0.42, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-8-fluoropyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 115015289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).