5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine

C10H12N4 — CID 82404941

IUPAC5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
SMILESc1cc(C2CCNC2)n2ncnc2c1
InChIInChI=1S/C10H12N4/c1-2-9(8-4-5-11-6-8)14-10(3-1)12-7-13-14/h1-3,7-8,11H,4-6H2
InChIKeyOKBRKIPKVFBEDS-UHFFFAOYSA-N
MW188.23 g/mol
LogP0.81
Rot. Bonds1

About 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine

5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 82404941) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID82404941
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
SMILESc1cc(C2CCNC2)n2ncnc2c1
InChIInChI=1S/C10H12N4/c1-2-9(8-4-5-11-6-8)14-10(3-1)12-7-13-14/h1-3,7-8,11H,4-6H2
InChIKeyOKBRKIPKVFBEDS-UHFFFAOYSA-N
XLogP0.81
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine (CID 82404941) is 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine is c1cc(C2CCNC2)n2ncnc2c1.
What is the InChIKey of 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is OKBRKIPKVFBEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-2-9(8-4-5-11-6-8)14-10(3-1)12-7-13-14/h1-3,7-8,11H,4-6H2.
What are the key properties of 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine?
5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 188.23 g/mol, XLogP of 0.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 82404941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).