(5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine

C5H11N5 — CID 13046502

IUPAC(5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine
SMILESCC(C)c1nc(NN)n[nH]1
InChIInChI=1S/C5H11N5/c1-3(2)4-7-5(8-6)10-9-4/h3H,6H2,1-2H3,(H2,7,8,9,10)
InChIKeyFRUYZBKOGXIPOA-UHFFFAOYSA-N
MW141.18 g/mol
LogP0.21
Rot. Bonds2

About (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine

(5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine (PubChem CID 13046502) has the molecular formula C5H11N5 and a molecular weight of 141.18 g/mol. Its IUPAC name is (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine.

Molecular Properties

Compound Name(5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine
PubChem CID13046502
Molecular FormulaC5H11N5
Molecular Weight141.18 g/mol
Exact Mass141.10
IUPAC Name(5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine
SMILESCC(C)c1nc(NN)n[nH]1
InChIInChI=1S/C5H11N5/c1-3(2)4-7-5(8-6)10-9-4/h3H,6H2,1-2H3,(H2,7,8,9,10)
InChIKeyFRUYZBKOGXIPOA-UHFFFAOYSA-N
XLogP0.21
TPSA79.62 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.18
LogP ≤ 50.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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 (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine?
The IUPAC name of (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine (CID 13046502) is (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine.
What is the SMILES notation for (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine?
The canonical SMILES for (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine is CC(C)c1nc(NN)n[nH]1.
What is the InChIKey of (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine?
The InChIKey is FRUYZBKOGXIPOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N5/c1-3(2)4-7-5(8-6)10-9-4/h3H,6H2,1-2H3,(H2,7,8,9,10).
What are the key properties of (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine?
(5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine has a molecular weight of 141.18 g/mol, XLogP of 0.21, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-propan-2-yl-1H-1,2,4-triazol-3-yl)hydrazine is sourced from PubChem (CID 13046502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).