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

C14H21N5 — CID 116989777

IUPAC7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccn2nc(C(C)(C)N3CCNCC3)nc2c1
InChIInChI=1S/C14H21N5/c1-11-4-7-19-12(10-11)16-13(17-19)14(2,3)18-8-5-15-6-9-18/h4,7,10,15H,5-6,8-9H2,1-3H3
InChIKeyURHMNWWMVCAFJI-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.18
Rot. Bonds2

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

7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 116989777) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID116989777
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccn2nc(C(C)(C)N3CCNCC3)nc2c1
InChIInChI=1S/C14H21N5/c1-11-4-7-19-12(10-11)16-13(17-19)14(2,3)18-8-5-15-6-9-18/h4,7,10,15H,5-6,8-9H2,1-3H3
InChIKeyURHMNWWMVCAFJI-UHFFFAOYSA-N
XLogP1.18
TPSA45.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.18
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
2-tert-butyl-7-piperazin-1-yl-[1,2,4]triazolo[1,5-a]pyridine
CID 117236422
7-methyl-2-(1-piperazin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 116989776
7-methyl-N-piperidin-1-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 83026136
(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)hydrazine
CID 116989782
7-methyl-N-(4-methylpiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 83025761
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
1-[2-(1-methylpyrazol-3-yl)propan-2-yl]piperazine
CID 112709168
N-(2,3-dihydro-1H-isoindol-5-ylmethyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 105358113
5-(1-methylpyrazol-3-yl)-3-(2-piperazin-1-ylpropan-2-yl)-1,2,4-oxadiazole
CID 103121926
2-[[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol
CID 114332664

Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (CID 116989777) is 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccn2nc(C(C)(C)N3CCNCC3)nc2c1.
What is the InChIKey of 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is URHMNWWMVCAFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-11-4-7-19-12(10-11)16-13(17-19)14(2,3)18-8-5-15-6-9-18/h4,7,10,15H,5-6,8-9H2,1-3H3.
What are the key properties of 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 259.36 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-(2-piperazin-1-ylpropan-2-yl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 116989777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).