phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone

C16H10F3NO — CID 15438193

IUPACphenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone
SMILESO=C(c1ccccc1)c1cc(C(F)(F)F)c2ccccn12
InChIInChI=1S/C16H10F3NO/c17-16(18,19)12-10-14(20-9-5-4-8-13(12)20)15(21)11-6-2-1-3-7-11/h1-10H
InChIKeyGVMDWDFPNSKHAR-UHFFFAOYSA-N
MW289.26 g/mol
LogP4.19
Rot. Bonds2

About phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone

phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone (PubChem CID 15438193) has the molecular formula C16H10F3NO and a molecular weight of 289.26 g/mol. Its IUPAC name is phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone.

Molecular Properties

Compound Namephenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone
PubChem CID15438193
Molecular FormulaC16H10F3NO
Molecular Weight289.26 g/mol
Exact Mass289.07
IUPAC Namephenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone
SMILESO=C(c1ccccc1)c1cc(C(F)(F)F)c2ccccn12
InChIInChI=1S/C16H10F3NO/c17-16(18,19)12-10-14(20-9-5-4-8-13(12)20)15(21)11-6-2-1-3-7-11/h1-10H
InChIKeyGVMDWDFPNSKHAR-UHFFFAOYSA-N
XLogP4.19
TPSA21.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.26
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

AM-694
CID 9889172
2-Benzoylpyridine
CID 7038
Jwh-167
CID 44397502
2-(2-fluorophenyl)-1-(1-pentyl-1H-indol-3-yl)ethanone
CID 44397516
(2,2,3,3-Tetramethylcyclopropyl)-[1-(4,4,4-trifluorobutyl)indol-3-yl]methanone
CID 11559386
1-(1-Methyl-1H-indol-3-yl)ethanone
CID 594156
2-Phenyl-1-(pyridin-2-yl)ethan-1-one
CID 256073
1-Methyl-3-(trifluoroacetyl)-1H-indole
CID 3524388
2-(3-fluorophenyl)-1-(1-pentyl-1H-indol-3-yl)ethanone
CID 44397383
2-(4-fluorophenyl)-1-(1-pentyl-1H-indol-3-yl)ethanone
CID 44397491
2-Amino-3-(4-fluorobenzoyl)indolizine-1-carboxamide
CID 5306648
N-(1-cyano-1-methylethyl)-2-oxo-2-(2-phenyl-3-indolizinyl)acetamide
CID 1566182

Frequently Asked Questions

What is the IUPAC name of phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone?
The IUPAC name of phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone (CID 15438193) is phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone.
What is the SMILES notation for phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone?
The canonical SMILES for phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone is O=C(c1ccccc1)c1cc(C(F)(F)F)c2ccccn12.
What is the InChIKey of phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone?
The InChIKey is GVMDWDFPNSKHAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3NO/c17-16(18,19)12-10-14(20-9-5-4-8-13(12)20)15(21)11-6-2-1-3-7-11/h1-10H.
What are the key properties of phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone?
phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone has a molecular weight of 289.26 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[1-(trifluoromethyl)indolizin-3-yl]methanone is sourced from PubChem (CID 15438193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).