5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol

C18H12F2N4O2 — CID 122506636

IUPAC5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol
SMILESOc1cc(F)ccc1-c1cnc2nc(COc3cncc(F)c3)cn2c1
InChIInChI=1S/C18H12F2N4O2/c19-12-1-2-16(17(25)4-12)11-5-22-18-23-14(9-24(18)8-11)10-26-15-3-13(20)6-21-7-15/h1-9,25H,10H2
InChIKeyFZCSBEFIWSODOE-UHFFFAOYSA-N
MW354.32 g/mol
LogP3.35
Rot. Bonds4

About 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol

5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol (PubChem CID 122506636) has the molecular formula C18H12F2N4O2 and a molecular weight of 354.32 g/mol. Its IUPAC name is 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol.

Molecular Properties

Compound Name5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol
PubChem CID122506636
Molecular FormulaC18H12F2N4O2
Molecular Weight354.32 g/mol
Exact Mass354.09
IUPAC Name5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol
SMILESOc1cc(F)ccc1-c1cnc2nc(COc3cncc(F)c3)cn2c1
InChIInChI=1S/C18H12F2N4O2/c19-12-1-2-16(17(25)4-12)11-5-22-18-23-14(9-24(18)8-11)10-26-15-3-13(20)6-21-7-15/h1-9,25H,10H2
InChIKeyFZCSBEFIWSODOE-UHFFFAOYSA-N
XLogP3.35
TPSA72.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.32
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol?
The IUPAC name of 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol (CID 122506636) is 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol.
What is the SMILES notation for 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol?
The canonical SMILES for 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol is Oc1cc(F)ccc1-c1cnc2nc(COc3cncc(F)c3)cn2c1.
What is the InChIKey of 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol?
The InChIKey is FZCSBEFIWSODOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2N4O2/c19-12-1-2-16(17(25)4-12)11-5-22-18-23-14(9-24(18)8-11)10-26-15-3-13(20)6-21-7-15/h1-9,25H,10H2.
What are the key properties of 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol?
5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol has a molecular weight of 354.32 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-[2-[(5-fluoro-3-pyridinyl)oxymethyl]imidazo[1,2-a]pyrimidin-6-yl]phenol is sourced from PubChem (CID 122506636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).