2-indol-1-yl-1-phenylethanol

C16H15NO — CID 11842267

IUPAC2-indol-1-yl-1-phenylethanol
SMILESOC(Cn1ccc2ccccc21)c1ccccc1
InChIInChI=1S/C16H15NO/c18-16(14-7-2-1-3-8-14)12-17-11-10-13-6-4-5-9-15(13)17/h1-11,16,18H,12H2
InChIKeyIZJUVVVGVLACJG-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.37
Rot. Bonds3

About 2-indol-1-yl-1-phenylethanol

2-indol-1-yl-1-phenylethanol (PubChem CID 11842267) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-indol-1-yl-1-phenylethanol.

Molecular Properties

Compound Name2-indol-1-yl-1-phenylethanol
PubChem CID11842267
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name2-indol-1-yl-1-phenylethanol
SMILESOC(Cn1ccc2ccccc21)c1ccccc1
InChIInChI=1S/C16H15NO/c18-16(14-7-2-1-3-8-14)12-17-11-10-13-6-4-5-9-15(13)17/h1-11,16,18H,12H2
InChIKeyIZJUVVVGVLACJG-UHFFFAOYSA-N
XLogP3.37
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-indol-1-yl-1-phenylethanol?
The IUPAC name of 2-indol-1-yl-1-phenylethanol (CID 11842267) is 2-indol-1-yl-1-phenylethanol.
What is the SMILES notation for 2-indol-1-yl-1-phenylethanol?
The canonical SMILES for 2-indol-1-yl-1-phenylethanol is OC(Cn1ccc2ccccc21)c1ccccc1.
What is the InChIKey of 2-indol-1-yl-1-phenylethanol?
The InChIKey is IZJUVVVGVLACJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c18-16(14-7-2-1-3-8-14)12-17-11-10-13-6-4-5-9-15(13)17/h1-11,16,18H,12H2.
What are the key properties of 2-indol-1-yl-1-phenylethanol?
2-indol-1-yl-1-phenylethanol has a molecular weight of 237.30 g/mol, XLogP of 3.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indol-1-yl-1-phenylethanol is sourced from PubChem (CID 11842267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).