[5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol

C19H15FN4O2 — CID 122506551

IUPAC[5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol
SMILESOCc1cc(F)ccc1-c1cnc2nc(COc3ccccn3)cn2c1
InChIInChI=1S/C19H15FN4O2/c20-15-4-5-17(13(7-15)11-25)14-8-22-19-23-16(10-24(19)9-14)12-26-18-3-1-2-6-21-18/h1-10,25H,11-12H2
InChIKeyFMZKBYVCUHZMQM-UHFFFAOYSA-N
MW350.35 g/mol
LogP3.00
Rot. Bonds5

About [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol

[5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol (PubChem CID 122506551) has the molecular formula C19H15FN4O2 and a molecular weight of 350.35 g/mol. Its IUPAC name is [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol.

Molecular Properties

Compound Name[5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol
PubChem CID122506551
Molecular FormulaC19H15FN4O2
Molecular Weight350.35 g/mol
Exact Mass350.12
IUPAC Name[5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol
SMILESOCc1cc(F)ccc1-c1cnc2nc(COc3ccccn3)cn2c1
InChIInChI=1S/C19H15FN4O2/c20-15-4-5-17(13(7-15)11-25)14-8-22-19-23-16(10-24(19)9-14)12-26-18-3-1-2-6-21-18/h1-10,25H,11-12H2
InChIKeyFMZKBYVCUHZMQM-UHFFFAOYSA-N
XLogP3.00
TPSA72.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol?
The IUPAC name of [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol (CID 122506551) is [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol.
What is the SMILES notation for [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol?
The canonical SMILES for [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol is OCc1cc(F)ccc1-c1cnc2nc(COc3ccccn3)cn2c1.
What is the InChIKey of [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol?
The InChIKey is FMZKBYVCUHZMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O2/c20-15-4-5-17(13(7-15)11-25)14-8-22-19-23-16(10-24(19)9-14)12-26-18-3-1-2-6-21-18/h1-10,25H,11-12H2.
What are the key properties of [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol?
[5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol has a molecular weight of 350.35 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-[2-(pyridin-2-yloxymethyl)imidazo[1,2-a]pyrimidin-6-yl]phenyl]methanol is sourced from PubChem (CID 122506551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).