3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol

C15H11F6NO — CID 162383474

IUPAC3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol
SMILESOC1c2c(C(F)(F)F)cc(-c3cc(F)cc(F)c3)n2CCC1F
InChIInChI=1S/C15H11F6NO/c16-8-3-7(4-9(17)5-8)12-6-10(15(19,20)21)13-14(23)11(18)1-2-22(12)13/h3-6,11,14,23H,1-2H2
InChIKeyMVPXYRUNBVMRKJ-UHFFFAOYSA-N
MW335.25 g/mol
LogP4.23
Rot. Bonds1

About 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol

3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol (PubChem CID 162383474) has the molecular formula C15H11F6NO and a molecular weight of 335.25 g/mol. Its IUPAC name is 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol.

Molecular Properties

Compound Name3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol
PubChem CID162383474
Molecular FormulaC15H11F6NO
Molecular Weight335.25 g/mol
Exact Mass335.07
IUPAC Name3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol
SMILESOC1c2c(C(F)(F)F)cc(-c3cc(F)cc(F)c3)n2CCC1F
InChIInChI=1S/C15H11F6NO/c16-8-3-7(4-9(17)5-8)12-6-10(15(19,20)21)13-14(23)11(18)1-2-22(12)13/h3-6,11,14,23H,1-2H2
InChIKeyMVPXYRUNBVMRKJ-UHFFFAOYSA-N
XLogP4.23
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.25
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-Methyl-1H-pyrrol-2-yl)-2-phenyl-2-piperidin-1-yl-ethanol
CID 11231451
2-(Dibutylamino)-1-[2-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]pyridin-4-yl]ethanol
CID 90669382
5,6-Difluoro-1-(5-fluoro-3-pyridinyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydroindol-4-ol
CID 162383497
(3-Fluorophenyl)(pyridin-2-yl)methanol
CID 23467199
1-(1-Ethyl-5-phenylpyrrol-2-yl)-2,2,2-trifluoroethan-1-ol
CID 3127242
2-[3-Methylbutyl(4-methylpentyl)amino]-1-[2-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]-4-pyridinyl]ethanol
CID 90669385
2-(Dibutylamino)-1-[2-(trifluoromethyl)-6-[2-(trifluoromethyl)phenyl]-4-pyridinyl]ethanol
CID 90669698
(R)-[4-fluoro-2-(trifluoromethyl)phenyl]-pyridin-2-ylmethanol
CID 134941450
(1-methyl-1H-indol-2-yl)methanol
CID 295652
US20250042853, Example 72
CID 168252524
(R)-(2-fluorophenyl)-pyridin-2-ylmethanol
CID 101558393
(7S)-2-(2,6-difluorophenyl)-4-methyl-6,7-dihydro-5H-cyclopenta[b]pyridin-7-ol
CID 134966349

Frequently Asked Questions

What is the IUPAC name of 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol?
The IUPAC name of 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol (CID 162383474) is 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol.
What is the SMILES notation for 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol?
The canonical SMILES for 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol is OC1c2c(C(F)(F)F)cc(-c3cc(F)cc(F)c3)n2CCC1F.
What is the InChIKey of 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol?
The InChIKey is MVPXYRUNBVMRKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F6NO/c16-8-3-7(4-9(17)5-8)12-6-10(15(19,20)21)13-14(23)11(18)1-2-22(12)13/h3-6,11,14,23H,1-2H2.
What are the key properties of 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol?
3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol has a molecular weight of 335.25 g/mol, XLogP of 4.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,5-difluorophenyl)-7-fluoro-1-(trifluoromethyl)-5,6,7,8-tetrahydroindolizin-8-ol is sourced from PubChem (CID 162383474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).