2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one

C19H15F2N3O2 — CID 66550972

IUPAC2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one
SMILESO=C1N(c2ccc(F)cc2)CCc2nc(COc3ccc(F)cc3)cn21
InChIInChI=1S/C19H15F2N3O2/c20-13-1-5-16(6-2-13)23-10-9-18-22-15(11-24(18)19(23)25)12-26-17-7-3-14(21)4-8-17/h1-8,11H,9-10,12H2
InChIKeyJOCMWJJTDJCKCT-UHFFFAOYSA-N
MW355.34 g/mol
LogP3.77
Rot. Bonds4

About 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one

2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one (PubChem CID 66550972) has the molecular formula C19H15F2N3O2 and a molecular weight of 355.34 g/mol. Its IUPAC name is 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one.

Molecular Properties

Compound Name2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one
PubChem CID66550972
Molecular FormulaC19H15F2N3O2
Molecular Weight355.34 g/mol
Exact Mass355.11
IUPAC Name2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one
SMILESO=C1N(c2ccc(F)cc2)CCc2nc(COc3ccc(F)cc3)cn21
InChIInChI=1S/C19H15F2N3O2/c20-13-1-5-16(6-2-13)23-10-9-18-22-15(11-24(18)19(23)25)12-26-17-7-3-14(21)4-8-17/h1-8,11H,9-10,12H2
InChIKeyJOCMWJJTDJCKCT-UHFFFAOYSA-N
XLogP3.77
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.34
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one?
The IUPAC name of 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one (CID 66550972) is 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one.
What is the SMILES notation for 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one?
The canonical SMILES for 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one is O=C1N(c2ccc(F)cc2)CCc2nc(COc3ccc(F)cc3)cn21.
What is the InChIKey of 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one?
The InChIKey is JOCMWJJTDJCKCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3O2/c20-13-1-5-16(6-2-13)23-10-9-18-22-15(11-24(18)19(23)25)12-26-17-7-3-14(21)4-8-17/h1-8,11H,9-10,12H2.
What are the key properties of 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one?
2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one has a molecular weight of 355.34 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenoxy)methyl]-6-(4-fluorophenyl)-7,8-dihydroimidazo[1,2-c]pyrimidin-5-one is sourced from PubChem (CID 66550972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).