3,5-dimethylpyrazole-1-carbohydrazide

C6H10N4O — CID 91621814

IUPAC3,5-dimethylpyrazole-1-carbohydrazide
SMILESCc1cc(C)n(C(=O)NN)n1
InChIInChI=1S/C6H10N4O/c1-4-3-5(2)10(9-4)6(11)8-7/h3H,7H2,1-2H3,(H,8,11)
InChIKeyZGPVODCQDJPHDP-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.07
Rot. Bonds

About 3,5-dimethylpyrazole-1-carbohydrazide

3,5-dimethylpyrazole-1-carbohydrazide (PubChem CID 91621814) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 3,5-dimethylpyrazole-1-carbohydrazide.

Molecular Properties

Compound Name3,5-dimethylpyrazole-1-carbohydrazide
PubChem CID91621814
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name3,5-dimethylpyrazole-1-carbohydrazide
SMILESCc1cc(C)n(C(=O)NN)n1
InChIInChI=1S/C6H10N4O/c1-4-3-5(2)10(9-4)6(11)8-7/h3H,7H2,1-2H3,(H,8,11)
InChIKeyZGPVODCQDJPHDP-UHFFFAOYSA-N
XLogP-0.07
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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 3,5-dimethylpyrazole-1-carbohydrazide?
The IUPAC name of 3,5-dimethylpyrazole-1-carbohydrazide (CID 91621814) is 3,5-dimethylpyrazole-1-carbohydrazide.
What is the SMILES notation for 3,5-dimethylpyrazole-1-carbohydrazide?
The canonical SMILES for 3,5-dimethylpyrazole-1-carbohydrazide is Cc1cc(C)n(C(=O)NN)n1.
What is the InChIKey of 3,5-dimethylpyrazole-1-carbohydrazide?
The InChIKey is ZGPVODCQDJPHDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c1-4-3-5(2)10(9-4)6(11)8-7/h3H,7H2,1-2H3,(H,8,11).
What are the key properties of 3,5-dimethylpyrazole-1-carbohydrazide?
3,5-dimethylpyrazole-1-carbohydrazide has a molecular weight of 154.17 g/mol, XLogP of -0.07, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylpyrazole-1-carbohydrazide is sourced from PubChem (CID 91621814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).