3-(trifluoromethyl)-1H-indol-2-ol

C9H6F3NO — CID 154142036

IUPAC3-(trifluoromethyl)-1H-indol-2-ol
SMILESOc1[nH]c2ccccc2c1C(F)(F)F
InChIInChI=1S/C9H6F3NO/c10-9(11,12)7-5-3-1-2-4-6(5)13-8(7)14/h1-4,13-14H
InChIKeyQXBNPUGVWJNMLC-UHFFFAOYSA-N
MW201.15 g/mol
LogP2.89
Rot. Bonds

About 3-(trifluoromethyl)-1H-indol-2-ol

3-(trifluoromethyl)-1H-indol-2-ol (PubChem CID 154142036) has the molecular formula C9H6F3NO and a molecular weight of 201.15 g/mol. Its IUPAC name is 3-(trifluoromethyl)-1H-indol-2-ol.

Molecular Properties

Compound Name3-(trifluoromethyl)-1H-indol-2-ol
PubChem CID154142036
Molecular FormulaC9H6F3NO
Molecular Weight201.15 g/mol
Exact Mass201.04
IUPAC Name3-(trifluoromethyl)-1H-indol-2-ol
SMILESOc1[nH]c2ccccc2c1C(F)(F)F
InChIInChI=1S/C9H6F3NO/c10-9(11,12)7-5-3-1-2-4-6(5)13-8(7)14/h1-4,13-14H
InChIKeyQXBNPUGVWJNMLC-UHFFFAOYSA-N
XLogP2.89
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.15
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-3-(trifluoromethyl)-1H-indole
CID 147285687
3-[(2-hydroxy-1H-indol-3-yl)methyl]-1H-indol-2-ol
CID 11959861
2-methyl-1-(trifluoromethyl)-9H-carbazole
CID 173176935
CID 131863122
CID 131863122
3-pyridin-2-yl-4-(trifluoromethyl)-1H-quinolin-2-one
CID 154100470
9H-carbazole
CID 66668984
N-[3,5-bis(trifluoromethyl)phenyl]-2-hydroxy-1H-indole-3-carboxamide
CID 71381239
2-hydroxy-1H-indole-3-diazonium
CID 555023
2-piperidin-3-yl-3-(trifluoromethyl)-1H-indole
CID 67535251
2-(5-bromo-3-pyridinyl)-3-(trifluoromethyl)-1H-indole
CID 58215716
2-(trifluoromethyl)-1H-indol-4-ol
CID 67244990
(4-fluorophenyl)-[2-(trifluoromethyl)-1H-indol-3-yl]methanone
CID 131870896

Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethyl)-1H-indol-2-ol?
The IUPAC name of 3-(trifluoromethyl)-1H-indol-2-ol (CID 154142036) is 3-(trifluoromethyl)-1H-indol-2-ol.
What is the SMILES notation for 3-(trifluoromethyl)-1H-indol-2-ol?
The canonical SMILES for 3-(trifluoromethyl)-1H-indol-2-ol is Oc1[nH]c2ccccc2c1C(F)(F)F.
What is the InChIKey of 3-(trifluoromethyl)-1H-indol-2-ol?
The InChIKey is QXBNPUGVWJNMLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6F3NO/c10-9(11,12)7-5-3-1-2-4-6(5)13-8(7)14/h1-4,13-14H.
What are the key properties of 3-(trifluoromethyl)-1H-indol-2-ol?
3-(trifluoromethyl)-1H-indol-2-ol has a molecular weight of 201.15 g/mol, XLogP of 2.89, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethyl)-1H-indol-2-ol is sourced from PubChem (CID 154142036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).