5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine

C6H10N4 — CID 90299134

IUPAC5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine
SMILESC/C=C\n1nc(C)nc1N
InChIInChI=1S/C6H10N4/c1-3-4-10-6(7)8-5(2)9-10/h3-4H,1-2H3,(H2,7,8,9)/b4-3-
InChIKeyDEPOZZKIRPONNZ-ARJAWSKDSA-N
MW138.17 g/mol
LogP0.66
Rot. Bonds1

About 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine

5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine (PubChem CID 90299134) has the molecular formula C6H10N4 and a molecular weight of 138.17 g/mol. Its IUPAC name is 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine
PubChem CID90299134
Molecular FormulaC6H10N4
Molecular Weight138.17 g/mol
Exact Mass138.09
IUPAC Name5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine
SMILESC/C=C\n1nc(C)nc1N
InChIInChI=1S/C6H10N4/c1-3-4-10-6(7)8-5(2)9-10/h3-4H,1-2H3,(H2,7,8,9)/b4-3-
InChIKeyDEPOZZKIRPONNZ-ARJAWSKDSA-N
XLogP0.66
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-2-[(Z)-prop-1-enyl]-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

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine?
The IUPAC name of 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine (CID 90299134) is 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine.
What is the SMILES notation for 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine?
The canonical SMILES for 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine is C/C=C\n1nc(C)nc1N.
What is the InChIKey of 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine?
The InChIKey is DEPOZZKIRPONNZ-ARJAWSKDSA-N. The full InChI is InChI=1S/C6H10N4/c1-3-4-10-6(7)8-5(2)9-10/h3-4H,1-2H3,(H2,7,8,9)/b4-3-.
What are the key properties of 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine?
5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine has a molecular weight of 138.17 g/mol, XLogP of 0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[(Z)-prop-1-enyl]-1,2,4-triazol-3-amine is sourced from PubChem (CID 90299134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).