3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol

C11H15NO — CID 10976039

IUPAC3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol
SMILESOCCCC1Cc2ccccc2N1
InChIInChI=1S/C11H15NO/c13-7-3-5-10-8-9-4-1-2-6-11(9)12-10/h1-2,4,6,10,12-13H,3,5,7-8H2
InChIKeyBWEDDFZLEAXGJD-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.80
Rot. Bonds3

About 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol

3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol (PubChem CID 10976039) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol
PubChem CID10976039
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol
SMILESOCCCC1Cc2ccccc2N1
InChIInChI=1S/C11H15NO/c13-7-3-5-10-8-9-4-1-2-6-11(9)12-10/h1-2,4,6,10,12-13H,3,5,7-8H2
InChIKeyBWEDDFZLEAXGJD-UHFFFAOYSA-N
XLogP1.80
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-nonyl-2,3-dihydro-1H-indole
CID 65041926
2-(2,3-dihydro-1H-indol-2-yl)ethanamine;dihydrochloride
CID 165454907
2-(3-piperazin-1-ylpropyl)-2,3-dihydro-1H-indole
CID 115105505
[(2S)-2,3-dihydro-1H-indol-2-yl]methanamine
CID 82667971
(2S)-2-(iodomethyl)-2,3-dihydro-1H-indole
CID 26338665
(2R)-2-prop-2-enyl-2,3-dihydro-1H-indole
CID 1380957
(2R)-2-benzyl-2,3-dihydro-1H-indole
CID 71608217
N-[2-(2,3-dihydro-1H-indol-2-yl)ethyl]cyclopentanamine
CID 115105365
2-(2,3-dihydro-1H-indol-2-yl)-N-ethenylethanamine
CID 143815191
N-(4-hydroxybutyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 106842127
2-(2-methylbutyl)-2,3-dihydro-1H-indole
CID 65042120
N-[[(2S)-2,3-dihydro-1H-indol-2-yl]methyl]propan-2-amine
CID 130522123

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol?
The IUPAC name of 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol (CID 10976039) is 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol.
What is the SMILES notation for 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol?
The canonical SMILES for 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol is OCCCC1Cc2ccccc2N1.
What is the InChIKey of 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol?
The InChIKey is BWEDDFZLEAXGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c13-7-3-5-10-8-9-4-1-2-6-11(9)12-10/h1-2,4,6,10,12-13H,3,5,7-8H2.
What are the key properties of 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol?
3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol has a molecular weight of 177.25 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-indol-2-yl)propan-1-ol is sourced from PubChem (CID 10976039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).