5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole

C15H20N2O — CID 17053

IUPAC5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole
SMILESCOc1ccc2[nH]cc(CCN3CCCC3)c2c1
InChIInChI=1S/C15H20N2O/c1-18-13-4-5-15-14(10-13)12(11-16-15)6-9-17-7-2-3-8-17/h4-5,10-11,16H,2-3,6-9H2,1H3
InChIKeyKAASYKNZNPWPQG-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.81
Rot. Bonds4

About 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole

5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole (PubChem CID 17053) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole.

Molecular Properties

Compound Name5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole
PubChem CID17053
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole
SMILESCOc1ccc2[nH]cc(CCN3CCCC3)c2c1
InChIInChI=1S/C15H20N2O/c1-18-13-4-5-15-14(10-13)12(11-16-15)6-9-17-7-2-3-8-17/h4-5,10-11,16H,2-3,6-9H2,1H3
InChIKeyKAASYKNZNPWPQG-UHFFFAOYSA-N
XLogP2.81
TPSA28.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole with MolForge

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

Launch Full Analysis

Related Compounds

Melatonin
CID 896
Serotonin
CID 5202
Bufotenine
CID 10257
O-Methylbufotenine
CID 1832
Harmaline
CID 3564
Harmine
CID 5280953
5-Methoxytryptamine
CID 1833
Tegaserod
CID 135409453
N-Acetylserotonin
CID 903
5-Hydroxytryptophol
CID 9061
Idalopirdine
CID 21071390
5-Methoxyindoleacetic acid
CID 18986

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole?
The IUPAC name of 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole (CID 17053) is 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole.
What is the SMILES notation for 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole?
The canonical SMILES for 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole is COc1ccc2[nH]cc(CCN3CCCC3)c2c1.
What is the InChIKey of 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole?
The InChIKey is KAASYKNZNPWPQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-18-13-4-5-15-14(10-13)12(11-16-15)6-9-17-7-2-3-8-17/h4-5,10-11,16H,2-3,6-9H2,1H3.
What are the key properties of 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole?
5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole has a molecular weight of 244.34 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-(2-pyrrolidin-1-ylethyl)-1H-indole is sourced from PubChem (CID 17053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).