3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol

C15H13NO3 — CID 117175071

IUPAC3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol
SMILESOc1ccc2[nH]cc(COc3ccccc3O)c2c1
InChIInChI=1S/C15H13NO3/c17-11-5-6-13-12(7-11)10(8-16-13)9-19-15-4-2-1-3-14(15)18/h1-8,16-18H,9H2
InChIKeyXVQSKRUDECZRNI-UHFFFAOYSA-N
MW255.27 g/mol
LogP3.16
Rot. Bonds3

About 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol

3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol (PubChem CID 117175071) has the molecular formula C15H13NO3 and a molecular weight of 255.27 g/mol. Its IUPAC name is 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol.

Molecular Properties

Compound Name3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol
PubChem CID117175071
Molecular FormulaC15H13NO3
Molecular Weight255.27 g/mol
Exact Mass255.09
IUPAC Name3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol
SMILESOc1ccc2[nH]cc(COc3ccccc3O)c2c1
InChIInChI=1S/C15H13NO3/c17-11-5-6-13-12(7-11)10(8-16-13)9-19-15-4-2-1-3-14(15)18/h1-8,16-18H,9H2
InChIKeyXVQSKRUDECZRNI-UHFFFAOYSA-N
XLogP3.16
TPSA65.48 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 53.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(5-amino-1H-indol-3-yl)methoxy]phenol
CID 117175069
3-[(5-hydroxy-1H-indol-3-yl)methyl]-1H-indol-5-ol
CID 15949127
3-[(2-fluorophenoxy)methyl]-1H-indol-5-amine
CID 117175051
5-chloro-3-[(2-chlorophenoxy)methyl]-1H-indole
CID 117175060
2-[(7-bromo-1H-indol-3-yl)methoxy]phenol
CID 117181897
3-[(5-fluoro-1H-indol-3-yl)methoxy]phenol
CID 117175120
3-[(2-fluorophenoxy)methyl]-5-methyl-1H-indole
CID 117185110
5-chloro-3-[(2-methylphenoxy)methyl]-1H-indole
CID 117175045
2-[(7-methyl-1H-indol-3-yl)methoxy]phenol
CID 117186217
3-(2-aminoethyl)-1H-indol-5-ol;sulfamide
CID 67549652
3-[(2-hydroxyphenoxy)methyl]-1-benzothiophen-5-ol
CID 117174722
3-fluoro-4-[(2-hydroxyphenoxy)methyl]phenol
CID 117219510

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol?
The IUPAC name of 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol (CID 117175071) is 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol.
What is the SMILES notation for 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol?
The canonical SMILES for 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol is Oc1ccc2[nH]cc(COc3ccccc3O)c2c1.
What is the InChIKey of 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol?
The InChIKey is XVQSKRUDECZRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3/c17-11-5-6-13-12(7-11)10(8-16-13)9-19-15-4-2-1-3-14(15)18/h1-8,16-18H,9H2.
What are the key properties of 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol?
3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol has a molecular weight of 255.27 g/mol, XLogP of 3.16, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxyphenoxy)methyl]-1H-indol-5-ol is sourced from PubChem (CID 117175071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).