4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one

C11H10FN3O — CID 86578902

IUPAC4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one
SMILESCn1c(-c2ccccc2F)cc(N)nc1=O
InChIInChI=1S/C11H10FN3O/c1-15-9(6-10(13)14-11(15)16)7-4-2-3-5-8(7)12/h2-6H,1H3,(H2,13,14,16)
InChIKeyVZFRUYCZZOYJKZ-UHFFFAOYSA-N
MW219.22 g/mol
LogP1.17
Rot. Bonds1

About 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one

4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one (PubChem CID 86578902) has the molecular formula C11H10FN3O and a molecular weight of 219.22 g/mol. Its IUPAC name is 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one.

Molecular Properties

Compound Name4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one
PubChem CID86578902
Molecular FormulaC11H10FN3O
Molecular Weight219.22 g/mol
Exact Mass219.08
IUPAC Name4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one
SMILESCn1c(-c2ccccc2F)cc(N)nc1=O
InChIInChI=1S/C11H10FN3O/c1-15-9(6-10(13)14-11(15)16)7-4-2-3-5-8(7)12/h2-6H,1H3,(H2,13,14,16)
InChIKeyVZFRUYCZZOYJKZ-UHFFFAOYSA-N
XLogP1.17
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.22
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one?
The IUPAC name of 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one (CID 86578902) is 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one.
What is the SMILES notation for 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one?
The canonical SMILES for 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one is Cn1c(-c2ccccc2F)cc(N)nc1=O.
What is the InChIKey of 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one?
The InChIKey is VZFRUYCZZOYJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FN3O/c1-15-9(6-10(13)14-11(15)16)7-4-2-3-5-8(7)12/h2-6H,1H3,(H2,13,14,16).
What are the key properties of 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one?
4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one has a molecular weight of 219.22 g/mol, XLogP of 1.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(2-fluorophenyl)-1-methylpyrimidin-2-one is sourced from PubChem (CID 86578902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).