1-(1H-indol-3-yl)-2-piperidin-1-ylethanol

C15H20N2O — CID 3599332

IUPAC1-(1H-indol-3-yl)-2-piperidin-1-ylethanol
SMILESOC(CN1CCCCC1)c1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O/c18-15(11-17-8-4-1-5-9-17)13-10-16-14-7-3-2-6-12(13)14/h2-3,6-7,10,15-16,18H,1,4-5,8-9,11H2
InChIKeyIHMSRKHIYWTFAD-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.69
Rot. Bonds3

About 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol

1-(1H-indol-3-yl)-2-piperidin-1-ylethanol (PubChem CID 3599332) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol.

Molecular Properties

Compound Name1-(1H-indol-3-yl)-2-piperidin-1-ylethanol
PubChem CID3599332
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name1-(1H-indol-3-yl)-2-piperidin-1-ylethanol
SMILESOC(CN1CCCCC1)c1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O/c18-15(11-17-8-4-1-5-9-17)13-10-16-14-7-3-2-6-12(13)14/h2-3,6-7,10,15-16,18H,1,4-5,8-9,11H2
InChIKeyIHMSRKHIYWTFAD-UHFFFAOYSA-N
XLogP2.69
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 ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol?
The IUPAC name of 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol (CID 3599332) is 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol.
What is the SMILES notation for 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol?
The canonical SMILES for 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol is OC(CN1CCCCC1)c1c[nH]c2ccccc12.
What is the InChIKey of 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol?
The InChIKey is IHMSRKHIYWTFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-15(11-17-8-4-1-5-9-17)13-10-16-14-7-3-2-6-12(13)14/h2-3,6-7,10,15-16,18H,1,4-5,8-9,11H2.
What are the key properties of 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol?
1-(1H-indol-3-yl)-2-piperidin-1-ylethanol has a molecular weight of 244.34 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-3-yl)-2-piperidin-1-ylethanol is sourced from PubChem (CID 3599332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).