1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol

C16H22N2O — CID 82300700

IUPAC1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol
SMILESCn1cc(C(C)(O)C2CCCNC2)c2ccccc21
InChIInChI=1S/C16H22N2O/c1-16(19,12-6-5-9-17-10-12)14-11-18(2)15-8-4-3-7-13(14)15/h3-4,7-8,11-12,17,19H,5-6,9-10H2,1-2H3
InChIKeySEUMERMFKXEGMS-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.39
Rot. Bonds2

About 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol

1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol (PubChem CID 82300700) has the molecular formula C16H22N2O and a molecular weight of 258.37 g/mol. Its IUPAC name is 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol.

Molecular Properties

Compound Name1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol
PubChem CID82300700
Molecular FormulaC16H22N2O
Molecular Weight258.37 g/mol
Exact Mass258.17
IUPAC Name1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol
SMILESCn1cc(C(C)(O)C2CCCNC2)c2ccccc21
InChIInChI=1S/C16H22N2O/c1-16(19,12-6-5-9-17-10-12)14-11-18(2)15-8-4-3-7-13(14)15/h3-4,7-8,11-12,17,19H,5-6,9-10H2,1-2H3
InChIKeySEUMERMFKXEGMS-UHFFFAOYSA-N
XLogP2.39
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,5-dimethylphenyl)-1-piperidin-3-ylethanol
CID 63586450
3-[1,1-bis(1-methylindol-3-yl)ethyl]-1-methylindole
CID 13205591
1-(4-tert-butylphenyl)-1-piperidin-3-ylethanol
CID 63586623
1-piperidin-3-yl-1-(2,3,4-trifluorophenyl)ethanol
CID 63587550
2-cyclopropyl-2-(1-methylindol-3-yl)propan-1-amine
CID 83840061
1-(2-fluoro-5-methylphenyl)-1-piperidin-3-ylethanol
CID 63586093
1-piperidin-3-yl-1-pyridin-3-ylethanol
CID 63585901
3-[1-cyclopropyl-2,2,2-trifluoro-1-(1-methylindol-3-yl)ethyl]-1-methylindole
CID 102130704
1-(4-aminophenyl)-1-piperidin-3-ylethanol
CID 115032208
cyclohexyl-phenyl-piperidin-3-ylmethanol
CID 23966017
1-(3,4-dihydro-2H-chromen-8-yl)-1-piperidin-3-ylethanol
CID 114743230
1-(1-benzothiophen-3-yl)-2-piperidin-3-ylpropan-2-ol
CID 65145479

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol?
The IUPAC name of 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol (CID 82300700) is 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol.
What is the SMILES notation for 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol?
The canonical SMILES for 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol is Cn1cc(C(C)(O)C2CCCNC2)c2ccccc21.
What is the InChIKey of 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol?
The InChIKey is SEUMERMFKXEGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-16(19,12-6-5-9-17-10-12)14-11-18(2)15-8-4-3-7-13(14)15/h3-4,7-8,11-12,17,19H,5-6,9-10H2,1-2H3.
What are the key properties of 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol?
1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol has a molecular weight of 258.37 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylindol-3-yl)-1-piperidin-3-ylethanol is sourced from PubChem (CID 82300700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).