5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one

C10H8F2N2O — CID 151885352

IUPAC5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one
SMILESO=C1N=CC(c2c(F)cccc2F)CN1
InChIInChI=1S/C10H8F2N2O/c11-7-2-1-3-8(12)9(7)6-4-13-10(15)14-5-6/h1-4,6H,5H2,(H,14,15)
InChIKeySPOVPEUVWKVMDP-UHFFFAOYSA-N
MW210.18 g/mol
LogP1.84
Rot. Bonds1

About 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one

5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one (PubChem CID 151885352) has the molecular formula C10H8F2N2O and a molecular weight of 210.18 g/mol. Its IUPAC name is 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one.

Molecular Properties

Compound Name5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one
PubChem CID151885352
Molecular FormulaC10H8F2N2O
Molecular Weight210.18 g/mol
Exact Mass210.06
IUPAC Name5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one
SMILESO=C1N=CC(c2c(F)cccc2F)CN1
InChIInChI=1S/C10H8F2N2O/c11-7-2-1-3-8(12)9(7)6-4-13-10(15)14-5-6/h1-4,6H,5H2,(H,14,15)
InChIKeySPOVPEUVWKVMDP-UHFFFAOYSA-N
XLogP1.84
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.18
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one?
The IUPAC name of 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one (CID 151885352) is 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one.
What is the SMILES notation for 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one?
The canonical SMILES for 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one is O=C1N=CC(c2c(F)cccc2F)CN1.
What is the InChIKey of 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one?
The InChIKey is SPOVPEUVWKVMDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2O/c11-7-2-1-3-8(12)9(7)6-4-13-10(15)14-5-6/h1-4,6H,5H2,(H,14,15).
What are the key properties of 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one?
5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one has a molecular weight of 210.18 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-difluorophenyl)-5,6-dihydro-1H-pyrimidin-2-one is sourced from PubChem (CID 151885352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).