2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine

C22H26N2 — CID 11099206

IUPAC2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine
SMILESCC(C1=C(CCN2CCCC2)Cc2ccccc21)c1ccccn1
InChIInChI=1S/C22H26N2/c1-17(21-10-4-5-12-23-21)22-19(11-15-24-13-6-7-14-24)16-18-8-2-3-9-20(18)22/h2-5,8-10,12,17H,6-7,11,13-16H2,1H3
InChIKeyRZZNAYPGBUQODF-UHFFFAOYSA-N
MW318.46 g/mol
LogP4.68
Rot. Bonds5

About 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine

2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine (PubChem CID 11099206) has the molecular formula C22H26N2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine.

Molecular Properties

Compound Name2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine
PubChem CID11099206
Molecular FormulaC22H26N2
Molecular Weight318.46 g/mol
Exact Mass318.21
IUPAC Name2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine
SMILESCC(C1=C(CCN2CCCC2)Cc2ccccc21)c1ccccn1
InChIInChI=1S/C22H26N2/c1-17(21-10-4-5-12-23-21)22-19(11-15-24-13-6-7-14-24)16-18-8-2-3-9-20(18)22/h2-5,8-10,12,17H,6-7,11,13-16H2,1H3
InChIKeyRZZNAYPGBUQODF-UHFFFAOYSA-N
XLogP4.68
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine?
The IUPAC name of 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine (CID 11099206) is 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine.
What is the SMILES notation for 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine?
The canonical SMILES for 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine is CC(C1=C(CCN2CCCC2)Cc2ccccc21)c1ccccn1.
What is the InChIKey of 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine?
The InChIKey is RZZNAYPGBUQODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2/c1-17(21-10-4-5-12-23-21)22-19(11-15-24-13-6-7-14-24)16-18-8-2-3-9-20(18)22/h2-5,8-10,12,17H,6-7,11,13-16H2,1H3.
What are the key properties of 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine?
2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine has a molecular weight of 318.46 g/mol, XLogP of 4.68, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[2-(2-pyrrolidin-1-ylethyl)-3H-inden-1-yl]ethyl]pyridine is sourced from PubChem (CID 11099206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).