1-buta-1,3-dienyl-1-methylhydrazine

C5H10N2 — CID 91065871

IUPAC1-buta-1,3-dienyl-1-methylhydrazine
SMILESC=CC=CN(C)N
InChIInChI=1S/C5H10N2/c1-3-4-5-7(2)6/h3-5H,1,6H2,2H3
InChIKeyUAOQJZXZWHZXKA-UHFFFAOYSA-N
MW98.15 g/mol
LogP0.49
Rot. Bonds2

About 1-buta-1,3-dienyl-1-methylhydrazine

1-buta-1,3-dienyl-1-methylhydrazine (PubChem CID 91065871) has the molecular formula C5H10N2 and a molecular weight of 98.15 g/mol. Its IUPAC name is 1-buta-1,3-dienyl-1-methylhydrazine.

Molecular Properties

Compound Name1-buta-1,3-dienyl-1-methylhydrazine
PubChem CID91065871
Molecular FormulaC5H10N2
Molecular Weight98.15 g/mol
Exact Mass98.08
IUPAC Name1-buta-1,3-dienyl-1-methylhydrazine
SMILESC=CC=CN(C)N
InChIInChI=1S/C5H10N2/c1-3-4-5-7(2)6/h3-5H,1,6H2,2H3
InChIKeyUAOQJZXZWHZXKA-UHFFFAOYSA-N
XLogP0.49
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.15
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(1Z,3Z)-N-[(1Z)-buta-1,3-dienyl]-N-methylhexa-1,3,5-trien-1-amine
CID 163917439
1-methyl-1-[(1E,3Z)-penta-1,3-dienyl]hydrazine
CID 174111731
(1Z)-N,N-dimethylbuta-1,3-dien-1-amine;ethane;propane
CID 143328939
N-[(1E)-buta-1,3-dienyl]-N-methylformamide
CID 58812160
(1E)-N-methyl-N-prop-2-enylbuta-1,3-dien-1-amine
CID 143685278
(3E,5E,7E,9E,11E,13E,15E)-octadeca-1,3,5,7,9,11,13,15,17-nonaene
CID 15379303
N'-[(1E,3Z)-hexa-1,3,5-trienyl]-N'-methylmethanediamine
CID 118121074
(1E)-N-methyl-N-propylbuta-1,3-dien-1-amine
CID 142943331
N-[(Z)-2-[amino(methyl)amino]ethenyl]methanimine
CID 143890415
1-[(1E)-buta-1,3-dienyl]-2-ethyl-1,2-dimethylhydrazine;ethane
CID 143701320
1-[(1Z)-buta-1,3-dienyl]-1-hex-1-en-3-ylhydrazine
CID 144683345
4-[[(1Z)-buta-1,3-dienyl]-methylamino]penta-1,3-dien-3-ol
CID 174156906

Frequently Asked Questions

What is the IUPAC name of 1-buta-1,3-dienyl-1-methylhydrazine?
The IUPAC name of 1-buta-1,3-dienyl-1-methylhydrazine (CID 91065871) is 1-buta-1,3-dienyl-1-methylhydrazine.
What is the SMILES notation for 1-buta-1,3-dienyl-1-methylhydrazine?
The canonical SMILES for 1-buta-1,3-dienyl-1-methylhydrazine is C=CC=CN(C)N.
What is the InChIKey of 1-buta-1,3-dienyl-1-methylhydrazine?
The InChIKey is UAOQJZXZWHZXKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2/c1-3-4-5-7(2)6/h3-5H,1,6H2,2H3.
What are the key properties of 1-buta-1,3-dienyl-1-methylhydrazine?
1-buta-1,3-dienyl-1-methylhydrazine has a molecular weight of 98.15 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-buta-1,3-dienyl-1-methylhydrazine is sourced from PubChem (CID 91065871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).