[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine

C14H19N3 — CID 84692922

IUPAC[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine
SMILESNCc1cccc2c(CN3CCCC3)c[nH]c12
InChIInChI=1S/C14H19N3/c15-8-11-4-3-5-13-12(9-16-14(11)13)10-17-6-1-2-7-17/h3-5,9,16H,1-2,6-8,10,15H2
InChIKeySARFOTDBIXAKIY-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.22
Rot. Bonds3

About [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine

[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine (PubChem CID 84692922) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine.

Molecular Properties

Compound Name[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine
PubChem CID84692922
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine
SMILESNCc1cccc2c(CN3CCCC3)c[nH]c12
InChIInChI=1S/C14H19N3/c15-8-11-4-3-5-13-12(9-16-14(11)13)10-17-6-1-2-7-17/h3-5,9,16H,1-2,6-8,10,15H2
InChIKeySARFOTDBIXAKIY-UHFFFAOYSA-N
XLogP2.22
TPSA45.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine 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

3-(azepan-1-ylmethyl)-7-fluoro-1H-indole
CID 117181792
[3-(piperidin-1-ylmethyl)-1H-indol-4-yl]methanamine
CID 117171053
7-chloro-3-(1,4-diazepan-1-ylmethyl)-1H-indole
CID 82501403
3-[(4-methylpiperazin-1-yl)methyl]-1H-indol-7-amine
CID 117181811
[3-(methylaminomethyl)-1H-indol-7-yl]methanamine
CID 117181665
1-[(7-ethyl-1H-indol-3-yl)methyl]pyrrolidin-3-amine
CID 55030032
[1-[(7-ethyl-1H-indol-3-yl)methyl]piperidin-3-yl]methanol
CID 110244912
1-[(7-ethyl-1H-indol-3-yl)methyl]azetidine-3-carboxylic acid
CID 65071937
3-[[7-(aminomethyl)-1H-indol-3-yl]methoxy]phenol
CID 117181704
4-[[7-(aminomethyl)-1H-indol-3-yl]methoxy]phenol
CID 117181714
[3-(propan-2-ylsulfonylmethyl)-1H-indol-7-yl]methanamine
CID 117181682
[7-(phenylmethoxymethyl)-1H-indol-3-yl]methanamine
CID 34178501

Frequently Asked Questions

What is the IUPAC name of [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine?
The IUPAC name of [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine (CID 84692922) is [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine.
What is the SMILES notation for [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine?
The canonical SMILES for [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine is NCc1cccc2c(CN3CCCC3)c[nH]c12.
What is the InChIKey of [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine?
The InChIKey is SARFOTDBIXAKIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c15-8-11-4-3-5-13-12(9-16-14(11)13)10-17-6-1-2-7-17/h3-5,9,16H,1-2,6-8,10,15H2.
What are the key properties of [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine?
[3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine has a molecular weight of 229.33 g/mol, XLogP of 2.22, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(pyrrolidin-1-ylmethyl)-1H-indol-7-yl]methanamine is sourced from PubChem (CID 84692922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).