2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol

C15H21NO — CID 115115167

IUPAC2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol
SMILESCC(C)(O)C1CN(C2CCC2)c2ccccc21
InChIInChI=1S/C15H21NO/c1-15(2,17)13-10-16(11-6-5-7-11)14-9-4-3-8-12(13)14/h3-4,8-9,11,13,17H,5-7,10H2,1-2H3
InChIKeyWETATWNHARNIDG-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.91
Rot. Bonds2

About 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol

2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol (PubChem CID 115115167) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol
PubChem CID115115167
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol
SMILESCC(C)(O)C1CN(C2CCC2)c2ccccc21
InChIInChI=1S/C15H21NO/c1-15(2,17)13-10-16(11-6-5-7-11)14-9-4-3-8-12(13)14/h3-4,8-9,11,13,17H,5-7,10H2,1-2H3
InChIKeyWETATWNHARNIDG-UHFFFAOYSA-N
XLogP2.91
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol?
The IUPAC name of 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol (CID 115115167) is 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol.
What is the SMILES notation for 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol?
The canonical SMILES for 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol is CC(C)(O)C1CN(C2CCC2)c2ccccc21.
What is the InChIKey of 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol?
The InChIKey is WETATWNHARNIDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-15(2,17)13-10-16(11-6-5-7-11)14-9-4-3-8-12(13)14/h3-4,8-9,11,13,17H,5-7,10H2,1-2H3.
What are the key properties of 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol?
2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol has a molecular weight of 231.34 g/mol, XLogP of 2.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclobutyl-2,3-dihydroindol-3-yl)propan-2-ol is sourced from PubChem (CID 115115167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).