2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol

C15H13NO2 — CID 13408376

IUPAC2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol
SMILESCc1c(-c2ccc(O)cc2)[nH]c2ccc(O)cc12
InChIInChI=1S/C15H13NO2/c1-9-13-8-12(18)6-7-14(13)16-15(9)10-2-4-11(17)5-3-10/h2-8,16-18H,1H3
InChIKeyOLSDYZLJXRSMAZ-UHFFFAOYSA-N
MW239.27 g/mol
LogP3.55
Rot. Bonds1

About 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol

2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol (PubChem CID 13408376) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol
PubChem CID13408376
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol
SMILESCc1c(-c2ccc(O)cc2)[nH]c2ccc(O)cc12
InChIInChI=1S/C15H13NO2/c1-9-13-8-12(18)6-7-14(13)16-15(9)10-2-4-11(17)5-3-10/h2-8,16-18H,1H3
InChIKeyOLSDYZLJXRSMAZ-UHFFFAOYSA-N
XLogP3.55
TPSA56.25 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol?
The IUPAC name of 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol (CID 13408376) is 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol.
What is the SMILES notation for 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol?
The canonical SMILES for 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol is Cc1c(-c2ccc(O)cc2)[nH]c2ccc(O)cc12.
What is the InChIKey of 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol?
The InChIKey is OLSDYZLJXRSMAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2/c1-9-13-8-12(18)6-7-14(13)16-15(9)10-2-4-11(17)5-3-10/h2-8,16-18H,1H3.
What are the key properties of 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol?
2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol has a molecular weight of 239.27 g/mol, XLogP of 3.55, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-3-methyl-1H-indol-5-ol is sourced from PubChem (CID 13408376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).