2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine

C10H18N4 — CID 130507760

IUPAC2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine
SMILESCC1CC(c2cnnn2C)CC(C)N1
InChIInChI=1S/C10H18N4/c1-7-4-9(5-8(2)12-7)10-6-11-13-14(10)3/h6-9,12H,4-5H2,1-3H3
InChIKeyUSAQVKIMYYVGKN-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.06
Rot. Bonds1

About 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine

2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine (PubChem CID 130507760) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine.

Molecular Properties

Compound Name2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine
PubChem CID130507760
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine
SMILESCC1CC(c2cnnn2C)CC(C)N1
InChIInChI=1S/C10H18N4/c1-7-4-9(5-8(2)12-7)10-6-11-13-14(10)3/h6-9,12H,4-5H2,1-3H3
InChIKeyUSAQVKIMYYVGKN-UHFFFAOYSA-N
XLogP1.06
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-5-(3-methyltriazol-4-yl)piperidine
CID 106781256
5-(azetidin-2-yl)-1-methyltriazole
CID 130959405
5-methyl-2-(3-methyltriazol-4-yl)-1,3-thiazolidine
CID 130921605
N,2-dimethyl-3-(3-methyltriazol-4-yl)cyclopentan-1-amine
CID 114690489
5-(5-chloro-2,2-dimethylcyclohexyl)-1-methyltriazole
CID 165491314
3-(3-methyltriazol-4-yl)-1-azabicyclo[2.2.2]octane
CID 15669963
1-(3-methyltriazol-4-yl)-1,2,3,4-tetrahydroisoquinoline
CID 114687785
4-ethyl-2-(3-methyltriazol-4-yl)cyclohexan-1-amine
CID 114691395
5-(2,6-dimethylpiperidin-4-yl)-1H-quinoxalin-2-one
CID 175903872
2,6-dimethyl-4-(4-methylphenyl)piperidine
CID 59343380
4-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-2,6-dimethylpiperidine
CID 114272278
4-(4-cyclobutylphenyl)-2,6-dimethylpiperidine
CID 114272272

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine?
The IUPAC name of 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine (CID 130507760) is 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine.
What is the SMILES notation for 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine?
The canonical SMILES for 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine is CC1CC(c2cnnn2C)CC(C)N1.
What is the InChIKey of 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine?
The InChIKey is USAQVKIMYYVGKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-7-4-9(5-8(2)12-7)10-6-11-13-14(10)3/h6-9,12H,4-5H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine?
2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine has a molecular weight of 194.28 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(3-methyltriazol-4-yl)piperidine is sourced from PubChem (CID 130507760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).