[2-(trifluoromethyl)-1H-indol-4-yl]methanol

C10H8F3NO — CID 84680774

IUPAC[2-(trifluoromethyl)-1H-indol-4-yl]methanol
SMILESOCc1cccc2[nH]c(C(F)(F)F)cc12
InChIInChI=1S/C10H8F3NO/c11-10(12,13)9-4-7-6(5-15)2-1-3-8(7)14-9/h1-4,14-15H,5H2
InChIKeyJFGGMYCKNLEJPV-UHFFFAOYSA-N
MW215.17 g/mol
LogP2.68
Rot. Bonds1

About [2-(trifluoromethyl)-1H-indol-4-yl]methanol

[2-(trifluoromethyl)-1H-indol-4-yl]methanol (PubChem CID 84680774) has the molecular formula C10H8F3NO and a molecular weight of 215.17 g/mol. Its IUPAC name is [2-(trifluoromethyl)-1H-indol-4-yl]methanol.

Molecular Properties

Compound Name[2-(trifluoromethyl)-1H-indol-4-yl]methanol
PubChem CID84680774
Molecular FormulaC10H8F3NO
Molecular Weight215.17 g/mol
Exact Mass215.06
IUPAC Name[2-(trifluoromethyl)-1H-indol-4-yl]methanol
SMILESOCc1cccc2[nH]c(C(F)(F)F)cc12
InChIInChI=1S/C10H8F3NO/c11-10(12,13)9-4-7-6(5-15)2-1-3-8(7)14-9/h1-4,14-15H,5H2
InChIKeyJFGGMYCKNLEJPV-UHFFFAOYSA-N
XLogP2.68
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.17
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-(trifluoromethyl)-1H-indol-4-yl]acetonitrile
CID 84789606
2-(trifluoromethyl)-1H-indol-4-ol
CID 67244990
2-[4-(hydroxymethyl)-1H-indol-2-yl]acetaldehyde
CID 151663676
9H-carbazol-1-ylmethanol
CID 10987211
1-[2-(trifluoromethyl)-1H-indol-4-yl]cyclopentan-1-amine
CID 117424144
[2-[(propan-2-ylamino)methyl]-1H-indol-4-yl]methanol
CID 70472768
1-[2-(trifluoromethyl)-1H-indol-4-yl]cyclohexan-1-amine
CID 117453561
5-[2-(trifluoromethyl)-1H-indol-4-yl]-1,2-oxazole-3-carboxylic acid
CID 117477202
1-[1-[2-(trifluoromethyl)-1H-indol-4-yl]cyclopropyl]ethanamine
CID 117424154
1-methyl-4-[2-(trifluoromethyl)-1H-indol-4-yl]pyrazol-5-amine
CID 117449657
[4-(fluoromethyl)-1H-indol-2-yl]boronic acid
CID 90840731
(5-aminonaphthalen-1-yl)methanol
CID 117275395

Frequently Asked Questions

What is the IUPAC name of [2-(trifluoromethyl)-1H-indol-4-yl]methanol?
The IUPAC name of [2-(trifluoromethyl)-1H-indol-4-yl]methanol (CID 84680774) is [2-(trifluoromethyl)-1H-indol-4-yl]methanol.
What is the SMILES notation for [2-(trifluoromethyl)-1H-indol-4-yl]methanol?
The canonical SMILES for [2-(trifluoromethyl)-1H-indol-4-yl]methanol is OCc1cccc2[nH]c(C(F)(F)F)cc12.
What is the InChIKey of [2-(trifluoromethyl)-1H-indol-4-yl]methanol?
The InChIKey is JFGGMYCKNLEJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3NO/c11-10(12,13)9-4-7-6(5-15)2-1-3-8(7)14-9/h1-4,14-15H,5H2.
What are the key properties of [2-(trifluoromethyl)-1H-indol-4-yl]methanol?
[2-(trifluoromethyl)-1H-indol-4-yl]methanol has a molecular weight of 215.17 g/mol, XLogP of 2.68, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(trifluoromethyl)-1H-indol-4-yl]methanol is sourced from PubChem (CID 84680774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).