1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol

C16H18N2O — CID 102545847

IUPAC1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol
SMILESCc1cc(N2CCc3ccccc32)ncc1C(C)O
InChIInChI=1S/C16H18N2O/c1-11-9-16(17-10-14(11)12(2)19)18-8-7-13-5-3-4-6-15(13)18/h3-6,9-10,12,19H,7-8H2,1-2H3
InChIKeyJYSKSXRYSNUFHA-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.14
Rot. Bonds2

About 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol

1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol (PubChem CID 102545847) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol.

Molecular Properties

Compound Name1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol
PubChem CID102545847
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol
SMILESCc1cc(N2CCc3ccccc32)ncc1C(C)O
InChIInChI=1S/C16H18N2O/c1-11-9-16(17-10-14(11)12(2)19)18-8-7-13-5-3-4-6-15(13)18/h3-6,9-10,12,19H,7-8H2,1-2H3
InChIKeyJYSKSXRYSNUFHA-UHFFFAOYSA-N
XLogP3.14
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[6-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-3-pyridinyl]propan-1-ol
CID 102545827
(1S)-1-[6-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-3-pyridinyl]ethanol
CID 124502141
1-(5-ethenyl-4-methyl-2-pyridinyl)-2,3-dihydroindole
CID 102545853
(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine
CID 124502165
[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine
CID 102545843
(R)-[6-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-3-pyridinyl]-phenylmethanamine
CID 124502163
1-(5-tert-butylsulfanyl-4-methyl-2-pyridinyl)-3,4-dihydro-2H-quinoline
CID 102545834
[6-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-3-pyridinyl]methanol
CID 102545819
(1S)-1-[6-(3,4-dihydro-2H-quinolin-1-yl)-2-methyl-3-pyridinyl]ethanol
CID 124502668
1-[2-(2,3-dihydroindol-1-yl)-1,3-thiazol-5-yl]ethanol
CID 62752443
methyl 6-(3,4-dihydro-2H-quinolin-1-yl)-4-methylpyridine-3-carboxylate
CID 102545818
(S)-[6-(2,3-dihydroindol-1-yl)-5-methyl-3-pyridinyl]-phenylmethanol
CID 124501657

Frequently Asked Questions

What is the IUPAC name of 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol?
The IUPAC name of 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol (CID 102545847) is 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol.
What is the SMILES notation for 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol?
The canonical SMILES for 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol is Cc1cc(N2CCc3ccccc32)ncc1C(C)O.
What is the InChIKey of 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol?
The InChIKey is JYSKSXRYSNUFHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-11-9-16(17-10-14(11)12(2)19)18-8-7-13-5-3-4-6-15(13)18/h3-6,9-10,12,19H,7-8H2,1-2H3.
What are the key properties of 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol?
1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol has a molecular weight of 254.33 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol is sourced from PubChem (CID 102545847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).