2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol

C14H19NO2 — CID 117338548

IUPAC2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol
SMILESCOc1cc2cc(C)[nH]c2cc1C(C)(C)CO
InChIInChI=1S/C14H19NO2/c1-9-5-10-6-13(17-4)11(7-12(10)15-9)14(2,3)8-16/h5-7,15-16H,8H2,1-4H3
InChIKeyVWJWEGHHKWWODC-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.75
Rot. Bonds3

About 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol

2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol (PubChem CID 117338548) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol
PubChem CID117338548
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol
SMILESCOc1cc2cc(C)[nH]c2cc1C(C)(C)CO
InChIInChI=1S/C14H19NO2/c1-9-5-10-6-13(17-4)11(7-12(10)15-9)14(2,3)8-16/h5-7,15-16H,8H2,1-4H3
InChIKeyVWJWEGHHKWWODC-UHFFFAOYSA-N
XLogP2.75
TPSA45.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5,6-dimethoxy-2-methyl-1H-indole;ethane
CID 171088058
2-(2-methoxy-4-methyl-5-methylsulfanylphenyl)-2-methylpropan-1-ol
CID 117353825
2-(5-ethoxy-2-methoxy-4-methylphenyl)-2-methylpropan-1-ol
CID 117349596
2-(6-methoxy-1,3-benzodioxol-5-yl)-2-methylpropan-1-ol
CID 117321978
5-(1-hydroxy-2-methylpropan-2-yl)-2,4-dimethoxybenzoic acid
CID 117388809
4-(5-methoxy-2-methyl-1H-indol-6-yl)butan-1-amine
CID 117336849
2-(4,5-dimethoxy-2,3-dimethylphenyl)-2-methylpropan-1-ol
CID 117349580
2-[4,5-dimethoxy-2-(trifluoromethyl)phenyl]-2-methylpropan-1-ol
CID 117445820
2-(5-fluoro-2-methoxy-4-methylsulfonylphenyl)-2-methylpropan-1-ol
CID 117442386
2-[2-methoxy-5-(trifluoromethyl)phenyl]-2-methylpropan-1-ol
CID 117373100
carbon dioxide;5-chloro-6-methoxy-2-methyl-1H-indole
CID 161417002
2-(2,5-dichloro-4-methoxyphenyl)-2-methylpropan-1-ol
CID 82296791

Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol?
The IUPAC name of 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol (CID 117338548) is 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol?
The canonical SMILES for 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol is COc1cc2cc(C)[nH]c2cc1C(C)(C)CO.
What is the InChIKey of 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol?
The InChIKey is VWJWEGHHKWWODC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-9-5-10-6-13(17-4)11(7-12(10)15-9)14(2,3)8-16/h5-7,15-16H,8H2,1-4H3.
What are the key properties of 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol?
2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol has a molecular weight of 233.31 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-2-methyl-1H-indol-6-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 117338548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).