2-(2,3-dimethylindol-3-yl)-4-methoxyphenol

C17H17NO2 — CID 101145578

IUPAC2-(2,3-dimethylindol-3-yl)-4-methoxyphenol
SMILESCOc1ccc(O)c(C2(C)C(C)=Nc3ccccc32)c1
InChIInChI=1S/C17H17NO2/c1-11-17(2,13-6-4-5-7-15(13)18-11)14-10-12(20-3)8-9-16(14)19/h4-10,19H,1-3H3
InChIKeyVAVNUJCMFZCZFD-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.81
Rot. Bonds2

About 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol

2-(2,3-dimethylindol-3-yl)-4-methoxyphenol (PubChem CID 101145578) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol.

Molecular Properties

Compound Name2-(2,3-dimethylindol-3-yl)-4-methoxyphenol
PubChem CID101145578
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name2-(2,3-dimethylindol-3-yl)-4-methoxyphenol
SMILESCOc1ccc(O)c(C2(C)C(C)=Nc3ccccc32)c1
InChIInChI=1S/C17H17NO2/c1-11-17(2,13-6-4-5-7-15(13)18-11)14-10-12(20-3)8-9-16(14)19/h4-10,19H,1-3H3
InChIKeyVAVNUJCMFZCZFD-UHFFFAOYSA-N
XLogP3.81
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-2-(1-phenylcyclopentyl)phenol
CID 68895977
5-methoxy-2,3-dimethyl-3-[(E)-3-phenylprop-2-enyl]indole
CID 132601084
bis(2,3,3-trimethylindole);dihydrobromide
CID 175169971
3-hydroxy-3-(2-hydroxy-5-methoxyphenyl)-1H-indol-2-one
CID 15857499
2-[3-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl chloride
CID 87578848
2,3,3-trimethyl-5-phenylmethoxyindole
CID 153467530
5-(3-benzyl-2-methylindol-3-yl)-2,3-dimethoxyphenol
CID 135033807
2-[1-(1-aminoethyl)cyclopropyl]-5-methoxyphenol
CID 117296056
2-[2-(2-hydroxyphenyl)-6-pyridin-2-yl-1H-pyridin-2-yl]-4-methoxyphenol
CID 70186747
5-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-2,3,3-trimethylindole
CID 130209837
2,3-dimethylindole-3-carbaldehyde
CID 174957699
(E)-1-(3,3-dimethylindol-2-yl)-3-(4-methoxyphenyl)prop-2-en-1-one
CID 22887414

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol?
The IUPAC name of 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol (CID 101145578) is 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol.
What is the SMILES notation for 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol?
The canonical SMILES for 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol is COc1ccc(O)c(C2(C)C(C)=Nc3ccccc32)c1.
What is the InChIKey of 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol?
The InChIKey is VAVNUJCMFZCZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-11-17(2,13-6-4-5-7-15(13)18-11)14-10-12(20-3)8-9-16(14)19/h4-10,19H,1-3H3.
What are the key properties of 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol?
2-(2,3-dimethylindol-3-yl)-4-methoxyphenol has a molecular weight of 267.33 g/mol, XLogP of 3.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylindol-3-yl)-4-methoxyphenol is sourced from PubChem (CID 101145578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).