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

C3H9N5 — CID 86232410

IUPAC(3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine
SMILESCC1N=C(NN)NN1
InChIInChI=1S/C3H9N5/c1-2-5-3(6-4)8-7-2/h2,7H,4H2,1H3,(H2,5,6,8)
InChIKeyXFYIVNFOJXNUIV-UHFFFAOYSA-N
MW115.14 g/mol
LogP-1.74
Rot. Bonds

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

(3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine (PubChem CID 86232410) has the molecular formula C3H9N5 and a molecular weight of 115.14 g/mol. Its IUPAC name is (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine.

Molecular Properties

Compound Name(3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine
PubChem CID86232410
Molecular FormulaC3H9N5
Molecular Weight115.14 g/mol
Exact Mass115.09
IUPAC Name(3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine
SMILESCC1N=C(NN)NN1
InChIInChI=1S/C3H9N5/c1-2-5-3(6-4)8-7-2/h2,7H,4H2,1H3,(H2,5,6,8)
InChIKeyXFYIVNFOJXNUIV-UHFFFAOYSA-N
XLogP-1.74
TPSA74.47 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.14
LogP ≤ 5-1.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine?
The IUPAC name of (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine (CID 86232410) is (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine.
What is the SMILES notation for (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine?
The canonical SMILES for (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine is CC1N=C(NN)NN1.
What is the InChIKey of (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine?
The InChIKey is XFYIVNFOJXNUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N5/c1-2-5-3(6-4)8-7-2/h2,7H,4H2,1H3,(H2,5,6,8).
What are the key properties of (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine?
(3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine has a molecular weight of 115.14 g/mol, XLogP of -1.74, 0 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyl-2,3-dihydro-1H-1,2,4-triazol-5-yl)hydrazine is sourced from PubChem (CID 86232410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).