azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone

C15H11F3N4O2 — CID 118378971

IUPACazetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone
SMILESO=C(c1cnc2c(-c3cnco3)cc(C(F)(F)F)cn12)N1CCC1
InChIInChI=1S/C15H11F3N4O2/c16-15(17,18)9-4-10(12-6-19-8-24-12)13-20-5-11(22(13)7-9)14(23)21-2-1-3-21/h4-8H,1-3H2
InChIKeyFPCMJKXYPFUTIA-UHFFFAOYSA-N
MW336.27 g/mol
LogP2.85
Rot. Bonds2

About azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone

azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone (PubChem CID 118378971) has the molecular formula C15H11F3N4O2 and a molecular weight of 336.27 g/mol. Its IUPAC name is azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone.

Molecular Properties

Compound Nameazetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone
PubChem CID118378971
Molecular FormulaC15H11F3N4O2
Molecular Weight336.27 g/mol
Exact Mass336.08
IUPAC Nameazetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone
SMILESO=C(c1cnc2c(-c3cnco3)cc(C(F)(F)F)cn12)N1CCC1
InChIInChI=1S/C15H11F3N4O2/c16-15(17,18)9-4-10(12-6-19-8-24-12)13-20-5-11(22(13)7-9)14(23)21-2-1-3-21/h4-8H,1-3H2
InChIKeyFPCMJKXYPFUTIA-UHFFFAOYSA-N
XLogP2.85
TPSA63.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.27
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone?
The IUPAC name of azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone (CID 118378971) is azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone.
What is the SMILES notation for azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone?
The canonical SMILES for azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone is O=C(c1cnc2c(-c3cnco3)cc(C(F)(F)F)cn12)N1CCC1.
What is the InChIKey of azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone?
The InChIKey is FPCMJKXYPFUTIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3N4O2/c16-15(17,18)9-4-10(12-6-19-8-24-12)13-20-5-11(22(13)7-9)14(23)21-2-1-3-21/h4-8H,1-3H2.
What are the key properties of azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone?
azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone has a molecular weight of 336.27 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azetidin-1-yl-[8-(1,3-oxazol-5-yl)-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanone is sourced from PubChem (CID 118378971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).