6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine

C13H9F3N4O — CID 154047917

IUPAC6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
SMILESCOc1ncc(-c2cc(C(F)(F)F)c3nccn3c2)cn1
InChIInChI=1S/C13H9F3N4O/c1-21-12-18-5-9(6-19-12)8-4-10(13(14,15)16)11-17-2-3-20(11)7-8/h2-7H,1H3
InChIKeyKYAJCCFEALYWNN-UHFFFAOYSA-N
MW294.24 g/mol
LogP2.82
Rot. Bonds2

About 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine

6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine (PubChem CID 154047917) has the molecular formula C13H9F3N4O and a molecular weight of 294.24 g/mol. Its IUPAC name is 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
PubChem CID154047917
Molecular FormulaC13H9F3N4O
Molecular Weight294.24 g/mol
Exact Mass294.07
IUPAC Name6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
SMILESCOc1ncc(-c2cc(C(F)(F)F)c3nccn3c2)cn1
InChIInChI=1S/C13H9F3N4O/c1-21-12-18-5-9(6-19-12)8-4-10(13(14,15)16)11-17-2-3-20(11)7-8/h2-7H,1H3
InChIKeyKYAJCCFEALYWNN-UHFFFAOYSA-N
XLogP2.82
TPSA52.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.24
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-tert-butylphenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 90178680
6-(2-methylphenyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 90178615
1-[4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-5-methoxy-2-pyridinyl]ethanone
CID 164536561
6-(2-methoxyphenyl)-N-(3,3,3-trifluoropropyl)imidazo[1,2-a]pyridin-8-amine
CID 141352601
5-(8-methylimidazo[1,2-a]pyridin-6-yl)pyridin-3-ol
CID 155918342
6-(6-amino-3-pyridinyl)-N-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473562
1-[5-chloro-4-(8-fluoroimidazo[1,2-a]pyridin-6-yl)-2-pyridinyl]ethanone
CID 164536549
N-(3,4-dimethoxyphenyl)-6-(4-fluorophenyl)imidazo[1,2-a]pyrazin-8-amine
CID 59473196
5-(2-methoxypyrimidin-5-yl)-1-methylpyrrolo[2,3-b]pyridine-2-carboxylic acid
CID 166342718
6-tert-butylimidazo[2,1-a]isoquinoline
CID 58518039
8-cyclopropyl-6-(2,4-dimethoxypyrimidin-5-yl)imidazo[1,2-b]pyridazine;1-methyl-2-(trifluoromethyl)benzene
CID 157032652
3-[4-methoxy-3-(trifluoromethyl)phenyl]pyridine
CID 46317327

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine (CID 154047917) is 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine is COc1ncc(-c2cc(C(F)(F)F)c3nccn3c2)cn1.
What is the InChIKey of 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine?
The InChIKey is KYAJCCFEALYWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F3N4O/c1-21-12-18-5-9(6-19-12)8-4-10(13(14,15)16)11-17-2-3-20(11)7-8/h2-7H,1H3.
What are the key properties of 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine?
6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine has a molecular weight of 294.24 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxypyrimidin-5-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 154047917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).