2-pyrrolidin-2-yl-2H-pyrrole

C8H12N2 — CID 91545171

IUPAC2-pyrrolidin-2-yl-2H-pyrrole
SMILESC1=CC(C2CCCN2)N=C1
InChIInChI=1S/C8H12N2/c1-3-7(9-5-1)8-4-2-6-10-8/h1,3,5,7-8,10H,2,4,6H2
InChIKeyFNAXCHZQQZOVEA-UHFFFAOYSA-N
MW136.20 g/mol
LogP0.75
Rot. Bonds1

About 2-pyrrolidin-2-yl-2H-pyrrole

2-pyrrolidin-2-yl-2H-pyrrole (PubChem CID 91545171) has the molecular formula C8H12N2 and a molecular weight of 136.20 g/mol. Its IUPAC name is 2-pyrrolidin-2-yl-2H-pyrrole.

Molecular Properties

Compound Name2-pyrrolidin-2-yl-2H-pyrrole
PubChem CID91545171
Molecular FormulaC8H12N2
Molecular Weight136.20 g/mol
Exact Mass136.10
IUPAC Name2-pyrrolidin-2-yl-2H-pyrrole
SMILESC1=CC(C2CCCN2)N=C1
InChIInChI=1S/C8H12N2/c1-3-7(9-5-1)8-4-2-6-10-8/h1,3,5,7-8,10H,2,4,6H2
InChIKeyFNAXCHZQQZOVEA-UHFFFAOYSA-N
XLogP0.75
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.20
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-pyrrolidin-2-yl-2H-pyrrole 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-pyrrolidin-2-yl-2H-pyrrole?
The IUPAC name of 2-pyrrolidin-2-yl-2H-pyrrole (CID 91545171) is 2-pyrrolidin-2-yl-2H-pyrrole.
What is the SMILES notation for 2-pyrrolidin-2-yl-2H-pyrrole?
The canonical SMILES for 2-pyrrolidin-2-yl-2H-pyrrole is C1=CC(C2CCCN2)N=C1.
What is the InChIKey of 2-pyrrolidin-2-yl-2H-pyrrole?
The InChIKey is FNAXCHZQQZOVEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2/c1-3-7(9-5-1)8-4-2-6-10-8/h1,3,5,7-8,10H,2,4,6H2.
What are the key properties of 2-pyrrolidin-2-yl-2H-pyrrole?
2-pyrrolidin-2-yl-2H-pyrrole has a molecular weight of 136.20 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-2-yl-2H-pyrrole is sourced from PubChem (CID 91545171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).