4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine

C15H28N4 — CID 72926570

IUPAC4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine
SMILESCCn1nc(C)nc1CC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C15H28N4/c1-7-19-13(16-11(2)17-19)8-12-9-14(3,4)18-15(5,6)10-12/h12,18H,7-10H2,1-6H3
InChIKeyXJJAGWMNETVKPE-UHFFFAOYSA-N
MW264.42 g/mol
LogP2.71
Rot. Bonds3

About 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine

4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine (PubChem CID 72926570) has the molecular formula C15H28N4 and a molecular weight of 264.42 g/mol. Its IUPAC name is 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine
PubChem CID72926570
Molecular FormulaC15H28N4
Molecular Weight264.42 g/mol
Exact Mass264.23
IUPAC Name4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine
SMILESCCn1nc(C)nc1CC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C15H28N4/c1-7-19-13(16-11(2)17-19)8-12-9-14(3,4)18-15(5,6)10-12/h12,18H,7-10H2,1-6H3
InChIKeyXJJAGWMNETVKPE-UHFFFAOYSA-N
XLogP2.71
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.42
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine (CID 72926570) is 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine is CCn1nc(C)nc1CC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine?
The InChIKey is XJJAGWMNETVKPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4/c1-7-19-13(16-11(2)17-19)8-12-9-14(3,4)18-15(5,6)10-12/h12,18H,7-10H2,1-6H3.
What are the key properties of 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine?
4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine has a molecular weight of 264.42 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethyl-5-methyl-1,2,4-triazol-3-yl)methyl]-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 72926570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).