3-methylbut-3-en-2-ylidenehydrazine

C5H10N2 — CID 76715077

IUPAC3-methylbut-3-en-2-ylidenehydrazine
SMILESC=C(C)C(C)=NN
InChIInChI=1S/C5H10N2/c1-4(2)5(3)7-6/h1,6H2,2-3H3
InChIKeyZDNJETHUMCSBIG-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.90
Rot. Bonds1

About 3-methylbut-3-en-2-ylidenehydrazine

3-methylbut-3-en-2-ylidenehydrazine (PubChem CID 76715077) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 3-methylbut-3-en-2-ylidenehydrazine.

Molecular Properties

Compound Name3-methylbut-3-en-2-ylidenehydrazine
PubChem CID76715077
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name3-methylbut-3-en-2-ylidenehydrazine
SMILESC=C(C)C(C)=NN
InChIInChI=1S/C5H10N2/c1-4(2)5(3)7-6/h1,6H2,2-3H3
InChIKeyZDNJETHUMCSBIG-UHFFFAOYSA-N
XLogP0.90
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.90
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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Related Compounds

4-Methylpent-3-en-2-ylidenehydrazine
CID 4605908
(Z)-4-methylpent-3-en-2-ylidenehydrazine
CID 6162438
3-Methylbut-3-en-2-imine
CID 20732293
(Z)-3-methylbut-3-en-2-ylidenehydrazine
CID 58175980
3-Methylbut-3-en-2-imine
CID 91430163
(Z)-[(Z)-4-iodo-3-methylbut-3-en-2-ylidene]hydrazine
CID 117804966
3-methyl-N-(methylideneamino)but-3-en-2-imine
CID 123420648
(Z)-3,4-dimethylpent-3-en-2-ylidenehydrazine
CID 142052030
(3-Imino-4-methylpent-4-en-2-ylidene)azanium
CID 142085215
4-Methylpent-4-ene-2,3-diimine
CID 142085216
(Z)-3-methyl-N-(methylideneamino)but-3-en-2-imine
CID 144164767
ethane;(Z)-3-methylbut-3-en-2-ylidenehydrazine
CID 144657423

Frequently Asked Questions

What is the IUPAC name of 3-methylbut-3-en-2-ylidenehydrazine?
The IUPAC name of 3-methylbut-3-en-2-ylidenehydrazine (CID 76715077) is 3-methylbut-3-en-2-ylidenehydrazine.
What is the SMILES notation for 3-methylbut-3-en-2-ylidenehydrazine?
The canonical SMILES for 3-methylbut-3-en-2-ylidenehydrazine is C=C(C)C(C)=NN.
What is the InChIKey of 3-methylbut-3-en-2-ylidenehydrazine?
The InChIKey is ZDNJETHUMCSBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-4(2)5(3)7-6/h1,6H2,2-3H3.
What are the key properties of 3-methylbut-3-en-2-ylidenehydrazine?
3-methylbut-3-en-2-ylidenehydrazine has a molecular weight of 98.15 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylbut-3-en-2-ylidenehydrazine is sourced from PubChem (CID 76715077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).