1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol

C15H20N2O — CID 3054781

IUPAC1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol
SMILESOC1CCCN(CCc2c[nH]c3ccccc23)C1
InChIInChI=1S/C15H20N2O/c18-13-4-3-8-17(11-13)9-7-12-10-16-15-6-2-1-5-14(12)15/h1-2,5-6,10,13,16,18H,3-4,7-9,11H2
InChIKeyKAALJGBKMIVRBZ-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.17
Rot. Bonds3

About 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol

1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol (PubChem CID 3054781) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol
PubChem CID3054781
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol
SMILESOC1CCCN(CCc2c[nH]c3ccccc23)C1
InChIInChI=1S/C15H20N2O/c18-13-4-3-8-17(11-13)9-7-12-10-16-15-6-2-1-5-14(12)15/h1-2,5-6,10,13,16,18H,3-4,7-9,11H2
InChIKeyKAALJGBKMIVRBZ-UHFFFAOYSA-N
XLogP2.17
TPSA39.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-pyrrolidin-1-ylethyl)-1H-indole
CID 26393
2-[(3S)-3-hydroxypiperidin-1-yl]-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 51924548
[(3S,4S)-4-hydroxy-1-[2-(1H-indol-3-yl)ethyl]piperidin-3-yl] methyl carbonate
CID 70459591
cyclopropyl-[4-[2-(1H-indol-3-yl)ethyl]piperazin-1-yl]methanone
CID 110602085
3-[4-[3-(2-fluorophenyl)piperidin-1-yl]butyl]-1H-indole
CID 70044838
[1-(1H-indol-3-ylmethyl)piperidin-3-yl]methanol
CID 43817859
ethyl [(3S,4S)-4-hydroxy-1-[2-(1H-indol-3-yl)ethyl]piperidin-3-yl] carbonate
CID 70459487
(3R,4R)-3-butyl-1-[2-(1H-indol-3-yl)ethyl]piperidin-4-amine
CID 68688509
(3R,4S)-3-butyl-1-[2-(1H-indol-3-yl)ethyl]piperidin-4-amine
CID 11645106
1-[2-(1H-indol-3-yl)ethyl]pyrrolidine-2-carbonitrile
CID 171079929
3-(2,2-dideuterio-2-pyrrolidin-1-ylethyl)-1H-indole
CID 166106987
1-[1-[2-(1H-indol-3-yl)ethyl]piperidin-4-yl]pyrrolidin-2-one
CID 56872329

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol?
The IUPAC name of 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol (CID 3054781) is 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol.
What is the SMILES notation for 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol?
The canonical SMILES for 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol is OC1CCCN(CCc2c[nH]c3ccccc23)C1.
What is the InChIKey of 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol?
The InChIKey is KAALJGBKMIVRBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-13-4-3-8-17(11-13)9-7-12-10-16-15-6-2-1-5-14(12)15/h1-2,5-6,10,13,16,18H,3-4,7-9,11H2.
What are the key properties of 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol?
1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol has a molecular weight of 244.34 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1H-indol-3-yl)ethyl]piperidin-3-ol is sourced from PubChem (CID 3054781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).