2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol

C16H18N2O — CID 102546514

IUPAC2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol
SMILESCc1nc(N2CCc3ccccc32)ccc1CCO
InChIInChI=1S/C16H18N2O/c1-12-13(9-11-19)6-7-16(17-12)18-10-8-14-4-2-3-5-15(14)18/h2-7,19H,8-11H2,1H3
InChIKeyRFQFFWMOVDUUOG-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.62
Rot. Bonds3

About 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol

2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol (PubChem CID 102546514) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol.

Molecular Properties

Compound Name2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol
PubChem CID102546514
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol
SMILESCc1nc(N2CCc3ccccc32)ccc1CCO
InChIInChI=1S/C16H18N2O/c1-12-13(9-11-19)6-7-16(17-12)18-10-8-14-4-2-3-5-15(14)18/h2-7,19H,8-11H2,1H3
InChIKeyRFQFFWMOVDUUOG-UHFFFAOYSA-N
XLogP2.62
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]ethanol
CID 102546944
[6-(6-fluoro-2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]methanol
CID 103501395
2-[6-(azepan-1-yl)-2-methyl-3-pyridinyl]ethanol
CID 102546243
1-(5-bromo-6-methyl-2-pyridinyl)-2,3,4,5-tetrahydro-1-benzazepine
CID 114047648
[6-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-3-pyridinyl]methanol
CID 79884530
(1S)-1-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methyl-3-pyridinyl]ethanol
CID 124502668
(1R)-1-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methyl-3-pyridinyl]ethanamine
CID 124502673
(1S)-1-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methyl-3-pyridinyl]ethanamine
CID 124502674
1-[5-(chloromethyl)-4-methylpyrimidin-2-yl]-2,3-dihydroindole
CID 83184652
1-[5-(bromomethyl)-2-pyridinyl]-2,3-dihydroindole
CID 107079443
1-(2-chloropyrimidin-4-yl)-2,3-dihydroindole
CID 22731926
[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine
CID 102545843

Frequently Asked Questions

What is the IUPAC name of 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol?
The IUPAC name of 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol (CID 102546514) is 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol.
What is the SMILES notation for 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol?
The canonical SMILES for 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol is Cc1nc(N2CCc3ccccc32)ccc1CCO.
What is the InChIKey of 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol?
The InChIKey is RFQFFWMOVDUUOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-13(9-11-19)6-7-16(17-12)18-10-8-14-4-2-3-5-15(14)18/h2-7,19H,8-11H2,1H3.
What are the key properties of 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol?
2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol has a molecular weight of 254.33 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(2,3-dihydroindol-1-yl)-2-methyl-3-pyridinyl]ethanol is sourced from PubChem (CID 102546514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).