6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one

C18H13FN4O2 — CID 66551375

IUPAC6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one
SMILESO=c1n(-c2ccc(F)cc2)ccc2nc(COc3ccccn3)cn12
InChIInChI=1S/C18H13FN4O2/c19-13-4-6-15(7-5-13)22-10-8-16-21-14(11-23(16)18(22)24)12-25-17-3-1-2-9-20-17/h1-11H,12H2
InChIKeyXOEQEJLSAVXHDQ-UHFFFAOYSA-N
MW336.33 g/mol
LogP2.60
Rot. Bonds4

About 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one

6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one (PubChem CID 66551375) has the molecular formula C18H13FN4O2 and a molecular weight of 336.33 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one.

Molecular Properties

Compound Name6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one
PubChem CID66551375
Molecular FormulaC18H13FN4O2
Molecular Weight336.33 g/mol
Exact Mass336.10
IUPAC Name6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one
SMILESO=c1n(-c2ccc(F)cc2)ccc2nc(COc3ccccn3)cn12
InChIInChI=1S/C18H13FN4O2/c19-13-4-6-15(7-5-13)22-10-8-16-21-14(11-23(16)18(22)24)12-25-17-3-1-2-9-20-17/h1-11H,12H2
InChIKeyXOEQEJLSAVXHDQ-UHFFFAOYSA-N
XLogP2.60
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.33
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one?
The IUPAC name of 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one (CID 66551375) is 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one.
What is the SMILES notation for 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one?
The canonical SMILES for 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one is O=c1n(-c2ccc(F)cc2)ccc2nc(COc3ccccn3)cn12.
What is the InChIKey of 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one?
The InChIKey is XOEQEJLSAVXHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13FN4O2/c19-13-4-6-15(7-5-13)22-10-8-16-21-14(11-23(16)18(22)24)12-25-17-3-1-2-9-20-17/h1-11H,12H2.
What are the key properties of 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one?
6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one has a molecular weight of 336.33 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-2-(pyridin-2-yloxymethyl)imidazo[1,2-c]pyrimidin-5-one is sourced from PubChem (CID 66551375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).