3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine

C5H12N6 — CID 130705310

IUPAC3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine
SMILESCCCc1nnc(NN)n1N
InChIInChI=1S/C5H12N6/c1-2-3-4-9-10-5(8-6)11(4)7/h2-3,6-7H2,1H3,(H,8,10)
InChIKeyAFZXKZINBBGMDK-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.77
Rot. Bonds3

About 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine

3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine (PubChem CID 130705310) has the molecular formula C5H12N6 and a molecular weight of 156.19 g/mol. Its IUPAC name is 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine.

Molecular Properties

Compound Name3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine
PubChem CID130705310
Molecular FormulaC5H12N6
Molecular Weight156.19 g/mol
Exact Mass156.11
IUPAC Name3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine
SMILESCCCc1nnc(NN)n1N
InChIInChI=1S/C5H12N6/c1-2-3-4-9-10-5(8-6)11(4)7/h2-3,6-7H2,1H3,(H,8,10)
InChIKeyAFZXKZINBBGMDK-UHFFFAOYSA-N
XLogP-0.77
TPSA94.78 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine?
The IUPAC name of 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine (CID 130705310) is 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine.
What is the SMILES notation for 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine?
The canonical SMILES for 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine is CCCc1nnc(NN)n1N.
What is the InChIKey of 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine?
The InChIKey is AFZXKZINBBGMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N6/c1-2-3-4-9-10-5(8-6)11(4)7/h2-3,6-7H2,1H3,(H,8,10).
What are the key properties of 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine?
3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine has a molecular weight of 156.19 g/mol, XLogP of -0.77, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-5-propyl-1,2,4-triazol-4-amine is sourced from PubChem (CID 130705310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).