6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine

C10H11ClN4 — CID 84750911

IUPAC6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
SMILESClc1ccc2nnc(C3CCCN3)n2c1
InChIInChI=1S/C10H11ClN4/c11-7-3-4-9-13-14-10(15(9)6-7)8-2-1-5-12-8/h3-4,6,8,12H,1-2,5H2
InChIKeyFNEIRUMELGCUMM-UHFFFAOYSA-N
MW222.68 g/mol
LogP1.81
Rot. Bonds1

About 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine

6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 84750911) has the molecular formula C10H11ClN4 and a molecular weight of 222.68 g/mol. Its IUPAC name is 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID84750911
Molecular FormulaC10H11ClN4
Molecular Weight222.68 g/mol
Exact Mass222.07
IUPAC Name6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
SMILESClc1ccc2nnc(C3CCCN3)n2c1
InChIInChI=1S/C10H11ClN4/c11-7-3-4-9-13-14-10(15(9)6-7)8-2-1-5-12-8/h3-4,6,8,12H,1-2,5H2
InChIKeyFNEIRUMELGCUMM-UHFFFAOYSA-N
XLogP1.81
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 117139170
6-fluoro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 84750912
3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
CID 117140176
3-(azepan-2-yl)-6-bromo-[1,2,4]triazolo[4,3-a]pyridine
CID 65348181
3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylic acid
CID 117140198
1-bromo-6-chloro-3-pyrrolidin-2-ylimidazo[1,5-a]pyridine
CID 84744073
3-piperidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine
CID 24711632
6-chloro-3-(thian-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138805
6-chloro-3-piperidin-2-yl-[1,2,4]triazolo[4,3-b]pyridazine
CID 84700446
6-(4-chlorophenyl)-3-[(2S)-piperidin-2-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 99982464
4-[(4-chlorophenyl)methyl]-3-methyl-5-[(2S)-pyrrolidin-2-yl]-1,2,4-triazole
CID 95180464
3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carbaldehyde
CID 117143547

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine (CID 84750911) is 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine is Clc1ccc2nnc(C3CCCN3)n2c1.
What is the InChIKey of 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is FNEIRUMELGCUMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4/c11-7-3-4-9-13-14-10(15(9)6-7)8-2-1-5-12-8/h3-4,6,8,12H,1-2,5H2.
What are the key properties of 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine?
6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 222.68 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-pyrrolidin-2-yl-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 84750911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).