5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine

C10H19N5 — CID 114431944

IUPAC5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine
SMILESCCC1CCNC(c2nc(N)n(C)n2)C1
InChIInChI=1S/C10H19N5/c1-3-7-4-5-12-8(6-7)9-13-10(11)15(2)14-9/h7-8,12H,3-6H2,1-2H3,(H2,11,13,14)
InChIKeyNKIOYTSTZKIDEB-UHFFFAOYSA-N
MW209.30 g/mol
LogP0.85
Rot. Bonds2

About 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine

5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine (PubChem CID 114431944) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine
PubChem CID114431944
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC Name5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine
SMILESCCC1CCNC(c2nc(N)n(C)n2)C1
InChIInChI=1S/C10H19N5/c1-3-7-4-5-12-8(6-7)9-13-10(11)15(2)14-9/h7-8,12H,3-6H2,1-2H3,(H2,11,13,14)
InChIKeyNKIOYTSTZKIDEB-UHFFFAOYSA-N
XLogP0.85
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine 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

2-methyl-5-[(2S)-piperidin-2-yl]-1,2,4-triazol-3-amine
CID 104915236
4-ethyl-2-(4-methoxy-1-methylpyrazol-5-yl)piperidine
CID 114663296
5-[4-(aminomethyl)cyclohexyl]-2-methyl-1,2,4-triazol-3-amine
CID 104605683
2-methyl-5-(piperidin-4-ylmethyl)-1,2,4-triazol-3-amine
CID 104605510
(2S)-4-ethyl-2-phenylpiperidine
CID 170718389
3-cyclooctyl-5-(4-ethylpiperidin-2-yl)-1,2,4-oxadiazole
CID 114429965
3-cyclohexyl-5-(4-ethylpiperidin-2-yl)-1,2,4-oxadiazole
CID 114429862
2-(4-ethylpiperidin-2-yl)-4-fluoro-1-methylbenzimidazole
CID 114427713
2-(4-ethylpiperidin-2-yl)-1,5-dimethylbenzimidazole
CID 114427691
2-(5-amino-1-methyl-1,2,4-triazol-3-yl)cyclobutane-1-carboxylic acid
CID 131097861
3-(cyclobutylmethyl)-5-(4-ethylpiperidin-2-yl)-1,2,4-oxadiazole
CID 112754183
5-(4,4-difluorocyclohexyl)-2-methyl-1,2,4-triazol-3-amine
CID 104605344

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine?
The IUPAC name of 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine (CID 114431944) is 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine.
What is the SMILES notation for 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine?
The canonical SMILES for 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine is CCC1CCNC(c2nc(N)n(C)n2)C1.
What is the InChIKey of 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine?
The InChIKey is NKIOYTSTZKIDEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-3-7-4-5-12-8(6-7)9-13-10(11)15(2)14-9/h7-8,12H,3-6H2,1-2H3,(H2,11,13,14).
What are the key properties of 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine?
5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine has a molecular weight of 209.30 g/mol, XLogP of 0.85, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylpiperidin-2-yl)-2-methyl-1,2,4-triazol-3-amine is sourced from PubChem (CID 114431944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).