1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol

C16H15F2NO — CID 103498394

IUPAC1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol
SMILESCC(O)c1ccc(N2CCc3ccc(F)cc32)c(F)c1
InChIInChI=1S/C16H15F2NO/c1-10(20)12-3-5-15(14(18)8-12)19-7-6-11-2-4-13(17)9-16(11)19/h2-5,8-10,20H,6-7H2,1H3
InChIKeyAQPTWWIASABETN-UHFFFAOYSA-N
MW275.30 g/mol
LogP3.71
Rot. Bonds2

About 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol

1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol (PubChem CID 103498394) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol.

Molecular Properties

Compound Name1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol
PubChem CID103498394
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC Name1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol
SMILESCC(O)c1ccc(N2CCc3ccc(F)cc32)c(F)c1
InChIInChI=1S/C16H15F2NO/c1-10(20)12-3-5-15(14(18)8-12)19-7-6-11-2-4-13(17)9-16(11)19/h2-5,8-10,20H,6-7H2,1H3
InChIKeyAQPTWWIASABETN-UHFFFAOYSA-N
XLogP3.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol 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

(1S)-1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496767
1-[4-(2,3-dihydroindol-1-yl)-3-fluorophenyl]ethanol
CID 43506012
(1S)-1-[4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol
CID 103498434
(1S)-1-[3-chloro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496697
(1R)-1-[3-chloro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496695
(1R)-1-[4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496814
1-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]ethanol
CID 43505896
(1S)-1-[3-fluoro-4-(4-methylpiperazin-1-yl)phenyl]ethanol
CID 78939132
(1S)-1-[2-fluoro-6-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanamine
CID 103496718
3-amino-4-(6-fluoro-2,3-dihydroindol-1-yl)benzoic acid
CID 103501357
(1R)-1-[2-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]propan-1-ol
CID 103498371
4-(6-fluoro-2,3-dihydroindol-1-yl)-3-methylbenzoic acid
CID 103496467

Frequently Asked Questions

What is the IUPAC name of 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol?
The IUPAC name of 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol (CID 103498394) is 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol.
What is the SMILES notation for 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol?
The canonical SMILES for 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol is CC(O)c1ccc(N2CCc3ccc(F)cc32)c(F)c1.
What is the InChIKey of 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol?
The InChIKey is AQPTWWIASABETN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c1-10(20)12-3-5-15(14(18)8-12)19-7-6-11-2-4-13(17)9-16(11)19/h2-5,8-10,20H,6-7H2,1H3.
What are the key properties of 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol?
1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol has a molecular weight of 275.30 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-fluoro-4-(6-fluoro-2,3-dihydroindol-1-yl)phenyl]ethanol is sourced from PubChem (CID 103498394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).