4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine

C11H15N5 — CID 83887716

IUPAC4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine
SMILESc1cc(CN2CCNCC2)c2cnnn2c1
InChIInChI=1S/C11H15N5/c1-2-10(9-15-6-3-12-4-7-15)11-8-13-14-16(11)5-1/h1-2,5,8,12H,3-4,6-7,9H2
InChIKeyCTQBCKJADDAGMW-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.13
Rot. Bonds2

About 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine

4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine (PubChem CID 83887716) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine
PubChem CID83887716
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine
SMILESc1cc(CN2CCNCC2)c2cnnn2c1
InChIInChI=1S/C11H15N5/c1-2-10(9-15-6-3-12-4-7-15)11-8-13-14-16(11)5-1/h1-2,5,8,12H,3-4,6-7,9H2
InChIKeyCTQBCKJADDAGMW-UHFFFAOYSA-N
XLogP0.13
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine
CID 83887715
4-(piperazin-1-ylmethyl)cinnoline
CID 83893270
1-[[2-(triazol-1-yl)phenyl]methyl]piperazine
CID 117360479
4-(piperazin-1-ylmethyl)-1H-indazole
CID 82509172
1-[(2-ethylphenyl)methyl]piperazine
CID 62415674
1-[(2-chloro-3-pyridinyl)methyl]piperazine
CID 62471076
2-ethyl-6-(piperazin-1-ylmethyl)aniline
CID 82509243
2-methyl-4-(piperazin-1-ylmethyl)-1,3-benzoxazole
CID 82510160
8-chloro-2-(piperazin-1-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 117258003
3-bromo-4-(piperazin-1-ylmethyl)-2H-indazole
CID 117475751
4-(piperazin-1-ylmethyl)benzene-1,2,3-triol
CID 12900434
4-(piperazin-1-ylmethyl)-1H-indole;dihydrochloride
CID 134690852

Frequently Asked Questions

What is the IUPAC name of 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine?
The IUPAC name of 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine (CID 83887716) is 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine.
What is the SMILES notation for 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine?
The canonical SMILES for 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine is c1cc(CN2CCNCC2)c2cnnn2c1.
What is the InChIKey of 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine?
The InChIKey is CTQBCKJADDAGMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-2-10(9-15-6-3-12-4-7-15)11-8-13-14-16(11)5-1/h1-2,5,8,12H,3-4,6-7,9H2.
What are the key properties of 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine?
4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine has a molecular weight of 217.28 g/mol, XLogP of 0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperazin-1-ylmethyl)triazolo[1,5-a]pyridine is sourced from PubChem (CID 83887716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).