hex-4-enylhydrazine

C6H14N2 — CID 54172904

IUPAChex-4-enylhydrazine
SMILESCC=CCCCNN
InChIInChI=1S/C6H14N2/c1-2-3-4-5-6-8-7/h2-3,8H,4-7H2,1H3
InChIKeyOWGJJKXPQXFMDH-UHFFFAOYSA-N
MW114.19 g/mol
LogP0.81
Rot. Bonds4

About hex-4-enylhydrazine

hex-4-enylhydrazine (PubChem CID 54172904) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is hex-4-enylhydrazine.

Molecular Properties

Compound Namehex-4-enylhydrazine
PubChem CID54172904
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Namehex-4-enylhydrazine
SMILESCC=CCCCNN
InChIInChI=1S/C6H14N2/c1-2-3-4-5-6-8-7/h2-3,8H,4-7H2,1H3
InChIKeyOWGJJKXPQXFMDH-UHFFFAOYSA-N
XLogP0.81
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 hex-4-enylhydrazine?
The IUPAC name of hex-4-enylhydrazine (CID 54172904) is hex-4-enylhydrazine.
What is the SMILES notation for hex-4-enylhydrazine?
The canonical SMILES for hex-4-enylhydrazine is CC=CCCCNN.
What is the InChIKey of hex-4-enylhydrazine?
The InChIKey is OWGJJKXPQXFMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-2-3-4-5-6-8-7/h2-3,8H,4-7H2,1H3.
What are the key properties of hex-4-enylhydrazine?
hex-4-enylhydrazine has a molecular weight of 114.19 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hex-4-enylhydrazine is sourced from PubChem (CID 54172904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).