butan-2-ylidenehydrazine

C4H10N2 — CID 71356052

IUPACbutan-2-ylidenehydrazine
SMILESCCC(C)=NN
InChIInChI=1S/C4H10N2/c1-3-4(2)6-5/h3,5H2,1-2H3
InChIKeyVPGUBZVWMHRRSS-UHFFFAOYSA-N
MW86.14 g/mol
LogP0.73
Rot. Bonds1

About butan-2-ylidenehydrazine

butan-2-ylidenehydrazine (PubChem CID 71356052) has the molecular formula C4H10N2 and a molecular weight of 86.14 g/mol. Its IUPAC name is butan-2-ylidenehydrazine.

Molecular Properties

Compound Namebutan-2-ylidenehydrazine
PubChem CID71356052
Molecular FormulaC4H10N2
Molecular Weight86.14 g/mol
Exact Mass86.08
IUPAC Namebutan-2-ylidenehydrazine
SMILESCCC(C)=NN
InChIInChI=1S/C4H10N2/c1-3-4(2)6-5/h3,5H2,1-2H3
InChIKeyVPGUBZVWMHRRSS-UHFFFAOYSA-N
XLogP0.73
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50086.14
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', '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 butan-2-ylidenehydrazine?
The IUPAC name of butan-2-ylidenehydrazine (CID 71356052) is butan-2-ylidenehydrazine.
What is the SMILES notation for butan-2-ylidenehydrazine?
The canonical SMILES for butan-2-ylidenehydrazine is CCC(C)=NN.
What is the InChIKey of butan-2-ylidenehydrazine?
The InChIKey is VPGUBZVWMHRRSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2/c1-3-4(2)6-5/h3,5H2,1-2H3.
What are the key properties of butan-2-ylidenehydrazine?
butan-2-ylidenehydrazine has a molecular weight of 86.14 g/mol, XLogP of 0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-ylidenehydrazine is sourced from PubChem (CID 71356052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).