2-ethyl-1-piperidin-1-yl-2,3-dihydroindole

C15H22N2 — CID 70589766

IUPAC2-ethyl-1-piperidin-1-yl-2,3-dihydroindole
SMILESCCC1Cc2ccccc2N1N1CCCCC1
InChIInChI=1S/C15H22N2/c1-2-14-12-13-8-4-5-9-15(13)17(14)16-10-6-3-7-11-16/h4-5,8-9,14H,2-3,6-7,10-12H2,1H3
InChIKeyCMRBMUBPVGHIIH-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.23
Rot. Bonds2

About 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole

2-ethyl-1-piperidin-1-yl-2,3-dihydroindole (PubChem CID 70589766) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole.

Molecular Properties

Compound Name2-ethyl-1-piperidin-1-yl-2,3-dihydroindole
PubChem CID70589766
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2-ethyl-1-piperidin-1-yl-2,3-dihydroindole
SMILESCCC1Cc2ccccc2N1N1CCCCC1
InChIInChI=1S/C15H22N2/c1-2-14-12-13-8-4-5-9-15(13)17(14)16-10-6-3-7-11-16/h4-5,8-9,14H,2-3,6-7,10-12H2,1H3
InChIKeyCMRBMUBPVGHIIH-UHFFFAOYSA-N
XLogP3.23
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole?
The IUPAC name of 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole (CID 70589766) is 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole.
What is the SMILES notation for 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole?
The canonical SMILES for 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole is CCC1Cc2ccccc2N1N1CCCCC1.
What is the InChIKey of 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole?
The InChIKey is CMRBMUBPVGHIIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-2-14-12-13-8-4-5-9-15(13)17(14)16-10-6-3-7-11-16/h4-5,8-9,14H,2-3,6-7,10-12H2,1H3.
What are the key properties of 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole?
2-ethyl-1-piperidin-1-yl-2,3-dihydroindole has a molecular weight of 230.35 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-piperidin-1-yl-2,3-dihydroindole is sourced from PubChem (CID 70589766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).