5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine

C13H18N4 — CID 117141686

IUPAC5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1cccc2nnc(CC3CCCN3C)n12
InChIInChI=1S/C13H18N4/c1-10-5-3-7-12-14-15-13(17(10)12)9-11-6-4-8-16(11)2/h3,5,7,11H,4,6,8-9H2,1-2H3
InChIKeyCEIZNOLVALXYJJ-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.67
Rot. Bonds2

About 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine

5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 117141686) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID117141686
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1cccc2nnc(CC3CCCN3C)n12
InChIInChI=1S/C13H18N4/c1-10-5-3-7-12-14-15-13(17(10)12)9-11-6-4-8-16(11)2/h3,5,7,11H,4,6,8-9H2,1-2H3
InChIKeyCEIZNOLVALXYJJ-UHFFFAOYSA-N
XLogP1.67
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-methyl-3-[(1-methylpyrrolidin-3-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117141381
5-chloro-3-[(1-propan-2-ylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117141708
3-[(5-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]thiane 1,1-dioxide
CID 117141782
5-methyl-2-[(1-methylpiperidin-2-yl)methyl]imidazo[1,2-a]pyridine
CID 117132185
3-[(1-methylpyrrolidin-2-yl)methyl]pyridazine
CID 117105994
[3-[(1-methylpyrrolidin-2-yl)methyl]imidazo[1,5-a]pyridin-5-yl]methanamine
CID 117140788
8-methyl-3-[(1-methylpiperidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117146706
[2-[(1-methylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyridin-5-yl]methanamine
CID 117132004
8-methyl-2-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridine
CID 117136735
3-(1-ethylpiperidin-2-yl)-5-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117141643
4-[(5-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl]phenol
CID 117142098
[2-[(1-methylpiperidin-2-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-5-yl]methanamine
CID 117132138

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine (CID 117141686) is 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine is Cc1cccc2nnc(CC3CCCN3C)n12.
What is the InChIKey of 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is CEIZNOLVALXYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-10-5-3-7-12-14-15-13(17(10)12)9-11-6-4-8-16(11)2/h3,5,7,11H,4,6,8-9H2,1-2H3.
What are the key properties of 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine?
5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 230.31 g/mol, XLogP of 1.67, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(1-methylpyrrolidin-2-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 117141686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).