4-methylpent-4-enylhydrazine

C6H14N2 — CID 105220751

IUPAC4-methylpent-4-enylhydrazine
SMILESC=C(C)CCCNN
InChIInChI=1S/C6H14N2/c1-6(2)4-3-5-8-7/h8H,1,3-5,7H2,2H3
InChIKeyKELDYYOYBBOPPI-UHFFFAOYSA-N
MW114.19 g/mol
LogP0.81
Rot. Bonds4

About 4-methylpent-4-enylhydrazine

4-methylpent-4-enylhydrazine (PubChem CID 105220751) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is 4-methylpent-4-enylhydrazine.

Molecular Properties

Compound Name4-methylpent-4-enylhydrazine
PubChem CID105220751
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name4-methylpent-4-enylhydrazine
SMILESC=C(C)CCCNN
InChIInChI=1S/C6H14N2/c1-6(2)4-3-5-8-7/h8H,1,3-5,7H2,2H3
InChIKeyKELDYYOYBBOPPI-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 4-methylpent-4-enylhydrazine?
The IUPAC name of 4-methylpent-4-enylhydrazine (CID 105220751) is 4-methylpent-4-enylhydrazine.
What is the SMILES notation for 4-methylpent-4-enylhydrazine?
The canonical SMILES for 4-methylpent-4-enylhydrazine is C=C(C)CCCNN.
What is the InChIKey of 4-methylpent-4-enylhydrazine?
The InChIKey is KELDYYOYBBOPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-6(2)4-3-5-8-7/h8H,1,3-5,7H2,2H3.
What are the key properties of 4-methylpent-4-enylhydrazine?
4-methylpent-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 4-methylpent-4-enylhydrazine is sourced from PubChem (CID 105220751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).