1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol

C15H21NO — CID 117204226

IUPAC1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol
SMILESCc1cc2c(CC(C)O)cccc2n1C(C)C
InChIInChI=1S/C15H21NO/c1-10(2)16-11(3)8-14-13(9-12(4)17)6-5-7-15(14)16/h5-8,10,12,17H,9H2,1-4H3
InChIKeyDXQBWGYCWAEDGL-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.45
Rot. Bonds3

About 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol

1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol (PubChem CID 117204226) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol.

Molecular Properties

Compound Name1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol
PubChem CID117204226
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol
SMILESCc1cc2c(CC(C)O)cccc2n1C(C)C
InChIInChI=1S/C15H21NO/c1-10(2)16-11(3)8-14-13(9-12(4)17)6-5-7-15(14)16/h5-8,10,12,17H,9H2,1-4H3
InChIKeyDXQBWGYCWAEDGL-UHFFFAOYSA-N
XLogP3.45
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-methyl-1-propan-2-ylindol-4-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

Related Compounds

1-(2-chloro-3-methylphenyl)propan-2-ol
CID 117279944
1-(3-bromo-2-methoxyphenyl)propan-2-ol
CID 83675437
1-[1-[(4-ethoxyphenyl)-hydroxymethyl]-2-methylindol-4-yl]propan-2-one
CID 142084555
1-[1-(cyclobutylmethyl)indol-4-yl]propan-2-ol
CID 115106892
1-(5-bromo-1-methylindol-3-yl)propan-2-ol
CID 83675916
(2R)-1-(3-bromo-2-fluorophenyl)propan-2-ol
CID 95757294
[1-propan-2-yl-2-(propan-2-yloxymethyl)indol-4-yl]methanamine
CID 117173654
1-(4-bromo-1-propan-2-ylindol-2-yl)-N,N-dimethylmethanamine
CID 117173714
2-[1-(methylamino)ethyl]-1-propan-2-ylindol-4-ol
CID 117194628
2-methyl-1-(4-methyl-1-propan-2-ylindol-2-yl)propan-2-ol
CID 117120348
1-(7-bromo-1-methylindol-3-yl)propan-2-ol
CID 83675918
1-[2-methoxy-3-(trifluoromethyl)phenyl]propan-2-ol
CID 117339947

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol?
The IUPAC name of 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol (CID 117204226) is 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol.
What is the SMILES notation for 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol?
The canonical SMILES for 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol is Cc1cc2c(CC(C)O)cccc2n1C(C)C.
What is the InChIKey of 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol?
The InChIKey is DXQBWGYCWAEDGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-10(2)16-11(3)8-14-13(9-12(4)17)6-5-7-15(14)16/h5-8,10,12,17H,9H2,1-4H3.
What are the key properties of 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol?
1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol has a molecular weight of 231.34 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-1-propan-2-ylindol-4-yl)propan-2-ol is sourced from PubChem (CID 117204226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).