7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine

C13H19N5 — CID 116989776

IUPAC7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccn2nc(C(C)N3CCNCC3)nc2c1
InChIInChI=1S/C13H19N5/c1-10-3-6-18-12(9-10)15-13(16-18)11(2)17-7-4-14-5-8-17/h3,6,9,11,14H,4-5,7-8H2,1-2H3
InChIKeySUKLHWFKLKQDOK-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.00
Rot. Bonds2

About 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine

7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 116989776) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID116989776
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccn2nc(C(C)N3CCNCC3)nc2c1
InChIInChI=1S/C13H19N5/c1-10-3-6-18-12(9-10)15-13(16-18)11(2)17-7-4-14-5-8-17/h3,6,9,11,14H,4-5,7-8H2,1-2H3
InChIKeySUKLHWFKLKQDOK-UHFFFAOYSA-N
XLogP1.00
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-methyl-2-(piperazin-1-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 116989716
7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
CID 116989777
3-methyl-2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)butanenitrile
CID 116989772
1-[(1S)-1-(3-methylphenyl)ethyl]piperazine
CID 92754613
3-methyl-2-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)butanoic acid
CID 116989763
1-[1-(2-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)ethyl]piperazine
CID 62722324
7-bromo-2-(2-piperazin-1-ylpropyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 116990080
N-(azepan-4-yl)-N,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 107173995
7-methyl-2-piperidin-3-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 83964859
3-amino-3-(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)propanoic acid
CID 116989744
4-methyl-2-[(1S)-1-piperazin-1-ylethyl]phenol
CID 93464487
7-methyl-N-(4-methylpiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 83025761

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine (CID 116989776) is 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccn2nc(C(C)N3CCNCC3)nc2c1.
What is the InChIKey of 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is SUKLHWFKLKQDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-10-3-6-18-12(9-10)15-13(16-18)11(2)17-7-4-14-5-8-17/h3,6,9,11,14H,4-5,7-8H2,1-2H3.
What are the key properties of 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine?
7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 245.33 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 116989776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).