1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one

C17H13F3N2O — CID 147033663

IUPAC1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)Cc1cccc2nccn12
InChIInChI=1S/C17H13F3N2O/c18-17(19,20)13-6-4-12(5-7-13)10-15(23)11-14-2-1-3-16-21-8-9-22(14)16/h1-9H,10-11H2
InChIKeyAYBSNDOUPOAZJA-UHFFFAOYSA-N
MW318.30 g/mol
LogP3.71
Rot. Bonds4

About 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one

1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one (PubChem CID 147033663) has the molecular formula C17H13F3N2O and a molecular weight of 318.30 g/mol. Its IUPAC name is 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one.

Molecular Properties

Compound Name1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one
PubChem CID147033663
Molecular FormulaC17H13F3N2O
Molecular Weight318.30 g/mol
Exact Mass318.10
IUPAC Name1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one
SMILESO=C(Cc1ccc(C(F)(F)F)cc1)Cc1cccc2nccn12
InChIInChI=1S/C17H13F3N2O/c18-17(19,20)13-6-4-12(5-7-13)10-15(23)11-14-2-1-3-16-21-8-9-22(14)16/h1-9H,10-11H2
InChIKeyAYBSNDOUPOAZJA-UHFFFAOYSA-N
XLogP3.71
TPSA34.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.30
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-tert-butylphenyl)-3-imidazo[1,2-a]pyridin-5-ylpropan-2-one
CID 158015272
1-[3-(difluoromethyl)-4-fluorophenyl]-3-imidazo[1,2-a]pyridin-5-ylpropan-2-one
CID 146695987
1-imidazo[1,2-a]pyridin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea
CID 11416355
1-(5-bromo-2-pyridinyl)-3-[4-(trifluoromethyl)phenyl]propan-2-one
CID 115800898
N-[3-chloro-4-(trifluoromethyl)phenyl]-2-imidazo[1,2-a]pyridin-5-ylacetamide
CID 125473568
3-oxo-4-[4-(trifluoromethyl)phenyl]butanoic acid
CID 53443936
5-(bromomethyl)imidazo[1,2-a]pyridine;hydrobromide
CID 121232171
imidazo[1,2-a]pyridin-5-ylmethanethiol
CID 89093379
1-methylsulfanyl-3-[4-(trifluoromethyl)phenyl]propan-2-one
CID 62692540
1-(2,2,2-trifluoroethylamino)-3-[4-(trifluoromethyl)phenyl]propan-2-one
CID 116588598
2-imidazo[1,2-a]pyridin-5-yl-N-(2-methylpyrazol-3-yl)acetamide
CID 125473491
2-imidazo[1,2-a]pyridin-5-yl-N-(5-methylpyrazin-2-yl)acetamide
CID 125473713

Frequently Asked Questions

What is the IUPAC name of 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one?
The IUPAC name of 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one (CID 147033663) is 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one.
What is the SMILES notation for 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one?
The canonical SMILES for 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one is O=C(Cc1ccc(C(F)(F)F)cc1)Cc1cccc2nccn12.
What is the InChIKey of 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one?
The InChIKey is AYBSNDOUPOAZJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F3N2O/c18-17(19,20)13-6-4-12(5-7-13)10-15(23)11-14-2-1-3-16-21-8-9-22(14)16/h1-9H,10-11H2.
What are the key properties of 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one?
1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one has a molecular weight of 318.30 g/mol, XLogP of 3.71, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazo[1,2-a]pyridin-5-yl-3-[4-(trifluoromethyl)phenyl]propan-2-one is sourced from PubChem (CID 147033663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).