2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine

C13H16N4 — CID 73439254

IUPAC2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine
SMILESCc1nccn1-c1cccc(C2CCCN2)n1
InChIInChI=1S/C13H16N4/c1-10-14-8-9-17(10)13-6-2-4-12(16-13)11-5-3-7-15-11/h2,4,6,8-9,11,15H,3,5,7H2,1H3
InChIKeyKNUWXIWCRCDCSN-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.00
Rot. Bonds2

About 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine

2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine (PubChem CID 73439254) has the molecular formula C13H16N4 and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine.

Molecular Properties

Compound Name2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine
PubChem CID73439254
Molecular FormulaC13H16N4
Molecular Weight228.30 g/mol
Exact Mass228.14
IUPAC Name2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine
SMILESCc1nccn1-c1cccc(C2CCCN2)n1
InChIInChI=1S/C13H16N4/c1-10-14-8-9-17(10)13-6-2-4-12(16-13)11-5-3-7-15-11/h2,4,6,8-9,11,15H,3,5,7H2,1H3
InChIKeyKNUWXIWCRCDCSN-UHFFFAOYSA-N
XLogP2.00
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine 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-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine?
The IUPAC name of 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine (CID 73439254) is 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine.
What is the SMILES notation for 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine?
The canonical SMILES for 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine is Cc1nccn1-c1cccc(C2CCCN2)n1.
What is the InChIKey of 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine?
The InChIKey is KNUWXIWCRCDCSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4/c1-10-14-8-9-17(10)13-6-2-4-12(16-13)11-5-3-7-15-11/h2,4,6,8-9,11,15H,3,5,7H2,1H3.
What are the key properties of 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine?
2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine has a molecular weight of 228.30 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylimidazol-1-yl)-6-pyrrolidin-2-ylpyridine is sourced from PubChem (CID 73439254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).