5-ethenyl-3-methyl-1,2,4-triazol-1-amine

C5H8N4 — CID 123415128

IUPAC5-ethenyl-3-methyl-1,2,4-triazol-1-amine
SMILESC=Cc1nc(C)nn1N
InChIInChI=1S/C5H8N4/c1-3-5-7-4(2)8-9(5)6/h3H,1,6H2,2H3
InChIKeyBPRRSHJSLBJPIZ-UHFFFAOYSA-N
MW124.15 g/mol
LogP-0.06
Rot. Bonds1

About 5-ethenyl-3-methyl-1,2,4-triazol-1-amine

5-ethenyl-3-methyl-1,2,4-triazol-1-amine (PubChem CID 123415128) has the molecular formula C5H8N4 and a molecular weight of 124.15 g/mol. Its IUPAC name is 5-ethenyl-3-methyl-1,2,4-triazol-1-amine.

Molecular Properties

Compound Name5-ethenyl-3-methyl-1,2,4-triazol-1-amine
PubChem CID123415128
Molecular FormulaC5H8N4
Molecular Weight124.15 g/mol
Exact Mass124.07
IUPAC Name5-ethenyl-3-methyl-1,2,4-triazol-1-amine
SMILESC=Cc1nc(C)nn1N
InChIInChI=1S/C5H8N4/c1-3-5-7-4(2)8-9(5)6/h3H,1,6H2,2H3
InChIKeyBPRRSHJSLBJPIZ-UHFFFAOYSA-N
XLogP-0.06
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.15
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-Amino-3,5-dimethyl-1,2,4-triazole
CID 229800
3,5-Diethyl-4h-1,2,4-triazol-4-amine
CID 221248
(E)-1-(3,5-dimethyl-1,2,4-triazol-1-yl)-2-fluorobut-2-en-1-imine
CID 166859713
3-Ethyl-5-methyl-1,2,4-triazol-4-amine
CID 10701840
3,5-Dimethyl-1,2,4-triazol-1-amine
CID 14338436
5-[(E)-prop-1-enyl]-1H-1,2,4-triazol-3-amine
CID 56979604
5-ethyl-3-[(E)-prop-1-enyl]-1H-1,2,4-triazole
CID 57179090
3-Ethenyl-5-methyl-1,2-diaza-4-azanidacyclopenta-2,5-diene;tungsten;tungsten(2+)
CID 58904784
3-ethenyl-5-methyl-1H-1,2,4-triazole
CID 58904785
3-Ethenyl-4,5-dimethyl-1,2,4-triazole
CID 91174647
3-Ethenyl-1,5-dimethyl-1,2,4-triazole
CID 129222124
3-[(1Z)-buta-1,3-dienyl]-5-methyl-1H-1,2,4-triazole
CID 130374264

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-3-methyl-1,2,4-triazol-1-amine?
The IUPAC name of 5-ethenyl-3-methyl-1,2,4-triazol-1-amine (CID 123415128) is 5-ethenyl-3-methyl-1,2,4-triazol-1-amine.
What is the SMILES notation for 5-ethenyl-3-methyl-1,2,4-triazol-1-amine?
The canonical SMILES for 5-ethenyl-3-methyl-1,2,4-triazol-1-amine is C=Cc1nc(C)nn1N.
What is the InChIKey of 5-ethenyl-3-methyl-1,2,4-triazol-1-amine?
The InChIKey is BPRRSHJSLBJPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4/c1-3-5-7-4(2)8-9(5)6/h3H,1,6H2,2H3.
What are the key properties of 5-ethenyl-3-methyl-1,2,4-triazol-1-amine?
5-ethenyl-3-methyl-1,2,4-triazol-1-amine has a molecular weight of 124.15 g/mol, XLogP of -0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-3-methyl-1,2,4-triazol-1-amine is sourced from PubChem (CID 123415128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).