1-ethyl-2-(4-hydroxyphenyl)indol-6-ol

C16H15NO2 — CID 13408378

IUPAC1-ethyl-2-(4-hydroxyphenyl)indol-6-ol
SMILESCCn1c(-c2ccc(O)cc2)cc2ccc(O)cc21
InChIInChI=1S/C16H15NO2/c1-2-17-15(11-3-6-13(18)7-4-11)9-12-5-8-14(19)10-16(12)17/h3-10,18-19H,2H2,1H3
InChIKeyZTHNRSICUJTQHL-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.74
Rot. Bonds2

About 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol

1-ethyl-2-(4-hydroxyphenyl)indol-6-ol (PubChem CID 13408378) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol.

Molecular Properties

Compound Name1-ethyl-2-(4-hydroxyphenyl)indol-6-ol
PubChem CID13408378
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name1-ethyl-2-(4-hydroxyphenyl)indol-6-ol
SMILESCCn1c(-c2ccc(O)cc2)cc2ccc(O)cc21
InChIInChI=1S/C16H15NO2/c1-2-17-15(11-3-6-13(18)7-4-11)9-12-5-8-14(19)10-16(12)17/h3-10,18-19H,2H2,1H3
InChIKeyZTHNRSICUJTQHL-UHFFFAOYSA-N
XLogP3.74
TPSA45.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-Hydroxyindole
CID 524508
Harmalol
CID 3565
4-Hydroxycarbazole
CID 104251
3H-Pyrido(3,4-b)indol-7-ol, 4,9-dihydro-1-methyl-, hydrochloride (1:1)
CID 145825
ZK 119010
CID 130936
FA 70
CID 9816234
2-Hydroxycarbazole
CID 93551
Phenol, 4,4'-indole-2,3-diyldi-
CID 201385
3-(2-(Dimethylamino)ethyl)-1H-indol-6-ol
CID 15124
3-Methyl-1-(3-methyl-2-buten-1-yl)-9H-carbazol-2-ol
CID 5209
3-methyl-9H-carbazol-2-ol
CID 3459141
4-(4-Hydroxy-3-methylphenyl)quinolin-7-ol
CID 135567366

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol?
The IUPAC name of 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol (CID 13408378) is 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol.
What is the SMILES notation for 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol?
The canonical SMILES for 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol is CCn1c(-c2ccc(O)cc2)cc2ccc(O)cc21.
What is the InChIKey of 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol?
The InChIKey is ZTHNRSICUJTQHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-2-17-15(11-3-6-13(18)7-4-11)9-12-5-8-14(19)10-16(12)17/h3-10,18-19H,2H2,1H3.
What are the key properties of 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol?
1-ethyl-2-(4-hydroxyphenyl)indol-6-ol has a molecular weight of 253.30 g/mol, XLogP of 3.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(4-hydroxyphenyl)indol-6-ol is sourced from PubChem (CID 13408378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).