3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole

C18H28N2 — CID 83055716

IUPAC3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
SMILESCCCC1CCCCN1CCC1CNc2ccccc21
InChIInChI=1S/C18H28N2/c1-2-7-16-8-5-6-12-20(16)13-11-15-14-19-18-10-4-3-9-17(15)18/h3-4,9-10,15-16,19H,2,5-8,11-14H2,1H3
InChIKeyFKHAYPLFVLUTIK-UHFFFAOYSA-N
MW272.44 g/mol
LogP4.24
Rot. Bonds5

About 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole

3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole (PubChem CID 83055716) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole.

Molecular Properties

Compound Name3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
PubChem CID83055716
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
SMILESCCCC1CCCCN1CCC1CNc2ccccc21
InChIInChI=1S/C18H28N2/c1-2-7-16-8-5-6-12-20(16)13-11-15-14-19-18-10-4-3-9-17(15)18/h3-4,9-10,15-16,19H,2,5-8,11-14H2,1H3
InChIKeyFKHAYPLFVLUTIK-UHFFFAOYSA-N
XLogP4.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2-propylpiperidin-1-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 83055722
3-[2-(2-cyclopentylpyrrolidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574822
3-[2-(2,5-dimethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80577266
3-[(2-methylazepan-1-yl)methyl]-2,3-dihydro-1H-indole
CID 80566561
3-[2-(3-ethylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80576591
2-(2,3-dihydro-1H-indol-3-yl)-1-(2-ethylpiperidin-1-yl)ethanone
CID 80573876
3-[2-(4-tert-butylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574620
1-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]pyrrolidin-2-one
CID 24700363
3-[2-(4-cyclopropylpiperazin-1-yl)ethyl]-2,3-dihydro-1H-indole
CID 80574811
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 80577284
(2S)-1-benzyl-2-propylpiperidine
CID 71407726
(3R)-3-ethyl-2,3-dihydro-1H-indole
CID 92797412

Frequently Asked Questions

What is the IUPAC name of 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The IUPAC name of 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole (CID 83055716) is 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole.
What is the SMILES notation for 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The canonical SMILES for 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole is CCCC1CCCCN1CCC1CNc2ccccc21.
What is the InChIKey of 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
The InChIKey is FKHAYPLFVLUTIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-2-7-16-8-5-6-12-20(16)13-11-15-14-19-18-10-4-3-9-17(15)18/h3-4,9-10,15-16,19H,2,5-8,11-14H2,1H3.
What are the key properties of 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole?
3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole has a molecular weight of 272.44 g/mol, XLogP of 4.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(2-propylpiperidin-1-yl)ethyl]-2,3-dihydro-1H-indole is sourced from PubChem (CID 83055716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).