3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine

C11H15N5 — CID 62690462

IUPAC3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine
SMILESc1cn2c(CC3CCCNC3)nnc2cn1
InChIInChI=1S/C11H15N5/c1-2-9(7-12-3-1)6-10-14-15-11-8-13-4-5-16(10)11/h4-5,8-9,12H,1-3,6-7H2
InChIKeyVUKTZUQRAIYNAY-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.67
Rot. Bonds2

About 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine

3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 62690462) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID62690462
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine
SMILESc1cn2c(CC3CCCNC3)nnc2cn1
InChIInChI=1S/C11H15N5/c1-2-9(7-12-3-1)6-10-14-15-11-8-13-4-5-16(10)11/h4-5,8-9,12H,1-3,6-7H2
InChIKeyVUKTZUQRAIYNAY-UHFFFAOYSA-N
XLogP0.67
TPSA55.11 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 ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine 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

3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrimidine
CID 62690629
[3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-7-yl]methanamine
CID 117143329
6-(piperidin-3-ylmethyl)imidazo[1,5-a]pyrimidine
CID 105470150
6-chloro-3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117139379
3-(2,3-dihydro-1H-indol-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine
CID 80577077
methyl 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine-6-carboxylate
CID 117140275
3-(piperidin-3-ylmethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrimidine
CID 136758156
3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridine-5-carbaldehyde
CID 117141091
(3R)-3-(1H-imidazol-5-ylmethyl)piperidine;dihydrochloride
CID 169426845
1-methyl-3-(piperidin-3-ylmethyl)pyrrolo[2,3-c]pyridine
CID 84692956
5-(piperidin-3-ylmethyl)-1,3-thiazole
CID 112644485
3-(piperidin-4-ylmethyl)imidazo[1,5-a]pyrazine
CID 84681989

Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine (CID 62690462) is 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine is c1cn2c(CC3CCCNC3)nnc2cn1.
What is the InChIKey of 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is VUKTZUQRAIYNAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-2-9(7-12-3-1)6-10-14-15-11-8-13-4-5-16(10)11/h4-5,8-9,12H,1-3,6-7H2.
What are the key properties of 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine?
3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 217.28 g/mol, XLogP of 0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-3-ylmethyl)-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 62690462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).