3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine

C16H11F4N3 — CID 71535399

IUPAC3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine
SMILESFc1ccc2nc(-c3cncc(C(F)(F)F)c3)c(C3CC3)n2c1
InChIInChI=1S/C16H11F4N3/c17-12-3-4-13-22-14(15(9-1-2-9)23(13)8-12)10-5-11(7-21-6-10)16(18,19)20/h3-9H,1-2H2
InChIKeyIRYAGXNONLSWLK-UHFFFAOYSA-N
MW321.28 g/mol
LogP4.43
Rot. Bonds2

About 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine

3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine (PubChem CID 71535399) has the molecular formula C16H11F4N3 and a molecular weight of 321.28 g/mol. Its IUPAC name is 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine
PubChem CID71535399
Molecular FormulaC16H11F4N3
Molecular Weight321.28 g/mol
Exact Mass321.09
IUPAC Name3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine
SMILESFc1ccc2nc(-c3cncc(C(F)(F)F)c3)c(C3CC3)n2c1
InChIInChI=1S/C16H11F4N3/c17-12-3-4-13-22-14(15(9-1-2-9)23(13)8-12)10-5-11(7-21-6-10)16(18,19)20/h3-9H,1-2H2
InChIKeyIRYAGXNONLSWLK-UHFFFAOYSA-N
XLogP4.43
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.28
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-1-Methyl-6-Phenylimidazo(4,5-b)Pyridine
CID 1530
Glu-P 1
CID 49971
Dipraglurant
CID 44557636
4-(1-(cyclopropylmethyl)-4-(4-fluorophenyl)-1H-imidazol-5-yl)pyrimidin-2-amine
CID 5172
6-Methyl-2-(4-methylphenyl)imidazo(1,2-a)pyridine
CID 667720
VK-19911
CID 9797240
2,6-Diphenylimidazo[1,2-a]pyridine
CID 58880626
2-(4-Fluorophenyl)imidazo[1,2-a]pyridine
CID 735319
4-(7-((Dimethylamino)methyl)-2-(4-fluorophenyl)imidazo(1,2-a)pyridin-3-yl)pyrimidin-2-amine
CID 10133248
6-[3-(2,2-Difluoroethyl)-5-(6-methylpyridin-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine
CID 135233366
SB-216995
CID 5171
(7R,8R)-8-(2,4,5-trifluorophenyl)-6,7,8,9-tetrahydroimidazo(1,2-a:4,5-c')dipyridin-7-amine
CID 15953860

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine?
The IUPAC name of 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine (CID 71535399) is 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine is Fc1ccc2nc(-c3cncc(C(F)(F)F)c3)c(C3CC3)n2c1.
What is the InChIKey of 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine?
The InChIKey is IRYAGXNONLSWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F4N3/c17-12-3-4-13-22-14(15(9-1-2-9)23(13)8-12)10-5-11(7-21-6-10)16(18,19)20/h3-9H,1-2H2.
What are the key properties of 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine?
3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine has a molecular weight of 321.28 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-6-fluoro-2-[5-(trifluoromethyl)-3-pyridinyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 71535399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).