6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine

C12H8F2N4O — CID 67241223

IUPAC6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
SMILESCOc1nc(-c2cnc3ccc(F)cn23)ncc1F
InChIInChI=1S/C12H8F2N4O/c1-19-12-8(14)4-16-11(17-12)9-5-15-10-3-2-7(13)6-18(9)10/h2-6H,1H3
InChIKeyLYWSPWIDDYFUAE-UHFFFAOYSA-N
MW262.22 g/mol
LogP2.08
Rot. Bonds2

About 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine

6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine (PubChem CID 67241223) has the molecular formula C12H8F2N4O and a molecular weight of 262.22 g/mol. Its IUPAC name is 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
PubChem CID67241223
Molecular FormulaC12H8F2N4O
Molecular Weight262.22 g/mol
Exact Mass262.07
IUPAC Name6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine
SMILESCOc1nc(-c2cnc3ccc(F)cn23)ncc1F
InChIInChI=1S/C12H8F2N4O/c1-19-12-8(14)4-16-11(17-12)9-5-15-10-3-2-7(13)6-18(9)10/h2-6H,1H3
InChIKeyLYWSPWIDDYFUAE-UHFFFAOYSA-N
XLogP2.08
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.22
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine (CID 67241223) is 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine is COc1nc(-c2cnc3ccc(F)cn23)ncc1F.
What is the InChIKey of 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is LYWSPWIDDYFUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N4O/c1-19-12-8(14)4-16-11(17-12)9-5-15-10-3-2-7(13)6-18(9)10/h2-6H,1H3.
What are the key properties of 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine?
6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 262.22 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-(5-fluoro-4-methoxypyrimidin-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 67241223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).