1-(1-propylpiperidin-4-yl)indole

C16H22N2 — CID 57300602

IUPAC1-(1-propylpiperidin-4-yl)indole
SMILESCCCN1CCC(n2ccc3ccccc32)CC1
InChIInChI=1S/C16H22N2/c1-2-10-17-11-8-15(9-12-17)18-13-7-14-5-3-4-6-16(14)18/h3-7,13,15H,2,8-12H2,1H3
InChIKeyGILILHAGYRMOAM-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.69
Rot. Bonds3

About 1-(1-propylpiperidin-4-yl)indole

1-(1-propylpiperidin-4-yl)indole (PubChem CID 57300602) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 1-(1-propylpiperidin-4-yl)indole.

Molecular Properties

Compound Name1-(1-propylpiperidin-4-yl)indole
PubChem CID57300602
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name1-(1-propylpiperidin-4-yl)indole
SMILESCCCN1CCC(n2ccc3ccccc32)CC1
InChIInChI=1S/C16H22N2/c1-2-10-17-11-8-15(9-12-17)18-13-7-14-5-3-4-6-16(14)18/h3-7,13,15H,2,8-12H2,1H3
InChIKeyGILILHAGYRMOAM-UHFFFAOYSA-N
XLogP3.69
TPSA8.17 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-propylpiperidin-4-yl)indole?
The IUPAC name of 1-(1-propylpiperidin-4-yl)indole (CID 57300602) is 1-(1-propylpiperidin-4-yl)indole.
What is the SMILES notation for 1-(1-propylpiperidin-4-yl)indole?
The canonical SMILES for 1-(1-propylpiperidin-4-yl)indole is CCCN1CCC(n2ccc3ccccc32)CC1.
What is the InChIKey of 1-(1-propylpiperidin-4-yl)indole?
The InChIKey is GILILHAGYRMOAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-2-10-17-11-8-15(9-12-17)18-13-7-14-5-3-4-6-16(14)18/h3-7,13,15H,2,8-12H2,1H3.
What are the key properties of 1-(1-propylpiperidin-4-yl)indole?
1-(1-propylpiperidin-4-yl)indole has a molecular weight of 242.37 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propylpiperidin-4-yl)indole is sourced from PubChem (CID 57300602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).