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

C12H16N4 — CID 117138746

IUPAC6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccc2nnc(C3CCN(C)C3)n2c1
InChIInChI=1S/C12H16N4/c1-9-3-4-11-13-14-12(16(11)7-9)10-5-6-15(2)8-10/h3-4,7,10H,5-6,8H2,1-2H3
InChIKeyFXVSRBMCBYOYPG-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.46
Rot. Bonds1

About 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine

6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 117138746) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID117138746
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCc1ccc2nnc(C3CCN(C)C3)n2c1
InChIInChI=1S/C12H16N4/c1-9-3-4-11-13-14-12(16(11)7-9)10-5-6-15(2)8-10/h3-4,7,10H,5-6,8H2,1-2H3
InChIKeyFXVSRBMCBYOYPG-UHFFFAOYSA-N
XLogP1.46
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138815
6-fluoro-3-[(3S)-1-methylpiperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 86687134
6-methyl-3-(oxan-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117138783
3-(azetidin-3-yl)-6-methyl-[1,2,4]triazolo[4,3-a]pyridine;dihydrochloride
CID 165431539
3-(1-methylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridine-6-carbaldehyde
CID 117138470
6-methyl-3-(oxan-2-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117139128
[3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridin-7-yl]methanamine
CID 117143204
[3-(1-methylpiperidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridin-7-yl]methanamine
CID 117143260
N-propan-2-yl-3-[1-(propan-2-ylcarbamoyl)pyrrolidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 118739118
1-bromo-7-methyl-3-(1-methylpyrrolidin-3-yl)imidazo[1,5-a]pyridine
CID 117251632
3-[(3R)-1-(dimethylcarbamoyl)pyrrolidin-3-yl]-N-(2,4-dimethylphenyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 95043018
6-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-amine
CID 590435

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine (CID 117138746) is 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine is Cc1ccc2nnc(C3CCN(C)C3)n2c1.
What is the InChIKey of 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is FXVSRBMCBYOYPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-9-3-4-11-13-14-12(16(11)7-9)10-5-6-15(2)8-10/h3-4,7,10H,5-6,8H2,1-2H3.
What are the key properties of 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine?
6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 216.29 g/mol, XLogP of 1.46, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(1-methylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 117138746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).