1-(1H-indol-2-yl)-2-methylpropan-1-ol

C12H15NO — CID 91442586

IUPAC1-(1H-indol-2-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1cc2ccccc2[nH]1
InChIInChI=1S/C12H15NO/c1-8(2)12(14)11-7-9-5-3-4-6-10(9)13-11/h3-8,12-14H,1-2H3
InChIKeyUNUBBHAGKLYPIP-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.86
Rot. Bonds2

About 1-(1H-indol-2-yl)-2-methylpropan-1-ol

1-(1H-indol-2-yl)-2-methylpropan-1-ol (PubChem CID 91442586) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 1-(1H-indol-2-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-(1H-indol-2-yl)-2-methylpropan-1-ol
PubChem CID91442586
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name1-(1H-indol-2-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1cc2ccccc2[nH]1
InChIInChI=1S/C12H15NO/c1-8(2)12(14)11-7-9-5-3-4-6-10(9)13-11/h3-8,12-14H,1-2H3
InChIKeyUNUBBHAGKLYPIP-UHFFFAOYSA-N
XLogP2.86
TPSA36.02 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-(1H-indol-2-yl)-2-methylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3S)-3-(1H-indol-2-yl)butanoic acid
CID 96762182
2-fluoro-1-(1H-indol-2-yl)-2-methylpropan-1-ol
CID 175731696
2-(1H-indol-2-yl)-3-methylbutanenitrile
CID 15013805
2-(1H-indol-2-yl)propanal
CID 88965178
2-hydroxy-2-(1H-indol-2-yl)acetonitrile
CID 84654386
1-(1H-indol-2-yl)prop-2-yn-1-ol
CID 172559122
2-amino-1-(1H-indol-2-yl)ethanol
CID 82599143
2-(1-methylsulfonylethyl)-1H-indole
CID 173051925
(3R)-3-(1H-indol-2-yl)-1-phenylbutan-1-one
CID 102472553
2-hydroxy-2-(1H-indol-2-yl)acetate
CID 19833059
ethyl (3S)-3-(1H-indol-2-yl)butanoate
CID 98010811
1H-indol-2-yl-(3-methylphenyl)methanol
CID 102056377

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-2-yl)-2-methylpropan-1-ol?
The IUPAC name of 1-(1H-indol-2-yl)-2-methylpropan-1-ol (CID 91442586) is 1-(1H-indol-2-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 1-(1H-indol-2-yl)-2-methylpropan-1-ol?
The canonical SMILES for 1-(1H-indol-2-yl)-2-methylpropan-1-ol is CC(C)C(O)c1cc2ccccc2[nH]1.
What is the InChIKey of 1-(1H-indol-2-yl)-2-methylpropan-1-ol?
The InChIKey is UNUBBHAGKLYPIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-8(2)12(14)11-7-9-5-3-4-6-10(9)13-11/h3-8,12-14H,1-2H3.
What are the key properties of 1-(1H-indol-2-yl)-2-methylpropan-1-ol?
1-(1H-indol-2-yl)-2-methylpropan-1-ol has a molecular weight of 189.26 g/mol, XLogP of 2.86, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-2-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 91442586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).