2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine

C12H20N4 — CID 115032296

IUPAC2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine
SMILESc1nnn(CC2CCCCN2)c1C1CCC1
InChIInChI=1S/C12H20N4/c1-2-7-13-11(6-1)9-16-12(8-14-15-16)10-4-3-5-10/h8,10-11,13H,1-7,9H2
InChIKeyGYZZYHAYSNZIBA-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.69
Rot. Bonds3

About 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine

2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine (PubChem CID 115032296) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine.

Molecular Properties

Compound Name2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine
PubChem CID115032296
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine
SMILESc1nnn(CC2CCCCN2)c1C1CCC1
InChIInChI=1S/C12H20N4/c1-2-7-13-11(6-1)9-16-12(8-14-15-16)10-4-3-5-10/h8,10-11,13H,1-7,9H2
InChIKeyGYZZYHAYSNZIBA-UHFFFAOYSA-N
XLogP1.69
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(5-chlorotriazol-1-yl)methyl]piperidine
CID 84776015
2-(5-cyclopentyltriazol-1-yl)ethanamine
CID 115015736
2-[2-(5-methyltriazol-1-yl)ethyl]piperidine
CID 82222439
2-[[3-(2-methylpropyl)triazol-4-yl]methyl]piperidine
CID 84687903
3-(5-cyclohexyltriazol-1-yl)propan-1-amine
CID 115026054
5-cyclobutyl-2-(piperidin-2-ylmethyl)-1H-pyrazol-3-one
CID 84727120
2-(pyrrol-1-ylmethyl)piperidine
CID 54001676
2-[(5-methoxy-3-methylpyrazol-1-yl)methyl]piperidine
CID 84722956
5-bromo-1-(pyrrolidin-2-ylmethyl)pyrazol-4-ol
CID 117232255
4-hydroxy-1-(piperidin-2-ylmethyl)pyrazole-5-carboxylic acid
CID 117232341
3-[3-(2-fluoroethyl)triazol-4-yl]piperidine
CID 84668324
5-fluoro-1-(piperidin-2-ylmethyl)indazole
CID 84796127

Frequently Asked Questions

What is the IUPAC name of 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine?
The IUPAC name of 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine (CID 115032296) is 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine.
What is the SMILES notation for 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine?
The canonical SMILES for 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine is c1nnn(CC2CCCCN2)c1C1CCC1.
What is the InChIKey of 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine?
The InChIKey is GYZZYHAYSNZIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-2-7-13-11(6-1)9-16-12(8-14-15-16)10-4-3-5-10/h8,10-11,13H,1-7,9H2.
What are the key properties of 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine?
2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine has a molecular weight of 220.32 g/mol, XLogP of 1.69, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-cyclobutyltriazol-1-yl)methyl]piperidine is sourced from PubChem (CID 115032296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).