2-(1H-indol-2-yl)-1-phenylethanol

C16H15NO — CID 102199311

IUPAC2-(1H-indol-2-yl)-1-phenylethanol
SMILESOC(Cc1cc2ccccc2[nH]1)c1ccccc1
InChIInChI=1S/C16H15NO/c18-16(12-6-2-1-3-7-12)11-14-10-13-8-4-5-9-15(13)17-14/h1-10,16-18H,11H2
InChIKeyKQBBAXJJWICYRX-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.44
Rot. Bonds3

About 2-(1H-indol-2-yl)-1-phenylethanol

2-(1H-indol-2-yl)-1-phenylethanol (PubChem CID 102199311) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-(1H-indol-2-yl)-1-phenylethanol.

Molecular Properties

Compound Name2-(1H-indol-2-yl)-1-phenylethanol
PubChem CID102199311
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name2-(1H-indol-2-yl)-1-phenylethanol
SMILESOC(Cc1cc2ccccc2[nH]1)c1ccccc1
InChIInChI=1S/C16H15NO/c18-16(12-6-2-1-3-7-12)11-14-10-13-8-4-5-9-15(13)17-14/h1-10,16-18H,11H2
InChIKeyKQBBAXJJWICYRX-UHFFFAOYSA-N
XLogP3.44
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-1-(1H-indol-2-yl)butan-2-ol;(2R)-3-(1H-indol-2-yl)propane-1,2-diol
CID 159659832
3-(1H-indol-2-yl)-2-methylpropanoic acid
CID 22476899
2-azaniumyl-3-(1H-indol-2-yl)propanoate
CID 23278059
(1R)-1,2-diphenylethanol
CID 1379022
1-(1H-indol-2-yl)butan-2-amine
CID 54026892
2-(2,3,3-trimethylbutyl)-1H-indole
CID 23522829
2-(2-fluoroethyl)-1H-indole
CID 142633825
dimethyl 2-(1H-indol-2-ylmethyl)propanedioate
CID 132519173
(2S)-2-[(2-aminoacetyl)amino]-3-(1H-indol-2-yl)propanoic acid
CID 14678463
2-(1H-indol-2-yl)ethanamine;hydroiodide
CID 175201769
(1S)-2-naphthalen-2-yl-1-phenylethanol
CID 101378142
N'-[1-(1H-indol-2-yl)propan-2-yl]ethanimidamide
CID 142165156

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-2-yl)-1-phenylethanol?
The IUPAC name of 2-(1H-indol-2-yl)-1-phenylethanol (CID 102199311) is 2-(1H-indol-2-yl)-1-phenylethanol.
What is the SMILES notation for 2-(1H-indol-2-yl)-1-phenylethanol?
The canonical SMILES for 2-(1H-indol-2-yl)-1-phenylethanol is OC(Cc1cc2ccccc2[nH]1)c1ccccc1.
What is the InChIKey of 2-(1H-indol-2-yl)-1-phenylethanol?
The InChIKey is KQBBAXJJWICYRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c18-16(12-6-2-1-3-7-12)11-14-10-13-8-4-5-9-15(13)17-14/h1-10,16-18H,11H2.
What are the key properties of 2-(1H-indol-2-yl)-1-phenylethanol?
2-(1H-indol-2-yl)-1-phenylethanol has a molecular weight of 237.30 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-2-yl)-1-phenylethanol is sourced from PubChem (CID 102199311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).