3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine

C11H12ClN3 — CID 83838573

IUPAC3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine
SMILESClc1cnc2cccc(C3CCNC3)n12
InChIInChI=1S/C11H12ClN3/c12-10-7-14-11-3-1-2-9(15(10)11)8-4-5-13-6-8/h1-3,7-8,13H,4-6H2
InChIKeyBQJCPMLGHHJPIB-UHFFFAOYSA-N
MW221.69 g/mol
LogP2.06
Rot. Bonds1

About 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine

3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine (PubChem CID 83838573) has the molecular formula C11H12ClN3 and a molecular weight of 221.69 g/mol. Its IUPAC name is 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine
PubChem CID83838573
Molecular FormulaC11H12ClN3
Molecular Weight221.69 g/mol
Exact Mass221.07
IUPAC Name3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine
SMILESClc1cnc2cccc(C3CCNC3)n12
InChIInChI=1S/C11H12ClN3/c12-10-7-14-11-3-1-2-9(15(10)11)8-4-5-13-6-8/h1-3,7-8,13H,4-6H2
InChIKeyBQJCPMLGHHJPIB-UHFFFAOYSA-N
XLogP2.06
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.69
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine?
The IUPAC name of 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine (CID 83838573) is 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine is Clc1cnc2cccc(C3CCNC3)n12.
What is the InChIKey of 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine?
The InChIKey is BQJCPMLGHHJPIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3/c12-10-7-14-11-3-1-2-9(15(10)11)8-4-5-13-6-8/h1-3,7-8,13H,4-6H2.
What are the key properties of 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine?
3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine has a molecular weight of 221.69 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-pyrrolidin-3-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 83838573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).