2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one

C11H9FN2O — CID 176681810

IUPAC2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(C2CC2)nc2ccc(F)cn12
InChIInChI=1S/C11H9FN2O/c12-8-3-4-10-13-9(7-1-2-7)5-11(15)14(10)6-8/h3-7H,1-2H2
InChIKeyINPYCKHOOVFKQY-UHFFFAOYSA-N
MW204.20 g/mol
LogP1.71
Rot. Bonds1

About 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one

2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one (PubChem CID 176681810) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one
PubChem CID176681810
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC Name2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one
SMILESO=c1cc(C2CC2)nc2ccc(F)cn12
InChIInChI=1S/C11H9FN2O/c12-8-3-4-10-13-9(7-1-2-7)5-11(15)14(10)6-8/h3-7H,1-2H2
InChIKeyINPYCKHOOVFKQY-UHFFFAOYSA-N
XLogP1.71
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one (CID 176681810) is 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one is O=c1cc(C2CC2)nc2ccc(F)cn12.
What is the InChIKey of 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one?
The InChIKey is INPYCKHOOVFKQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c12-8-3-4-10-13-9(7-1-2-7)5-11(15)14(10)6-8/h3-7H,1-2H2.
What are the key properties of 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one?
2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one has a molecular weight of 204.20 g/mol, XLogP of 1.71, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-7-fluoropyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 176681810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).