1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine

C15H26N2 — CID 105250143

IUPAC1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine
SMILESC=CC(NN)C12CC3CC(C)(CC(C)(C3)C1)C2
InChIInChI=1S/C15H26N2/c1-4-12(17-16)15-7-11-5-13(2,9-15)8-14(3,6-11)10-15/h4,11-12,17H,1,5-10,16H2,2-3H3
InChIKeyFVVVGKWBAQWNLE-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.00
Rot. Bonds3

About 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine

1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine (PubChem CID 105250143) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine.

Molecular Properties

Compound Name1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine
PubChem CID105250143
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine
SMILESC=CC(NN)C12CC3CC(C)(CC(C)(C3)C1)C2
InChIInChI=1S/C15H26N2/c1-4-12(17-16)15-7-11-5-13(2,9-15)8-14(3,6-11)10-15/h4,11-12,17H,1,5-10,16H2,2-3H3
InChIKeyFVVVGKWBAQWNLE-UHFFFAOYSA-N
XLogP3.00
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

1-(3-methyl-1-adamantyl)prop-2-enylhydrazine
CID 105318044
bis(1,3,5,7-tetramethyladamantane);1,3,5-trimethyladamantane
CID 158906766
1-(3,5-dimethyl-1-adamantyl)-N,2-dimethylprop-2-en-1-amine
CID 79987172
2-cyclohexyl-1-(3,5-dimethyl-1-adamantyl)ethanol
CID 79995433
1-(3,5-dimethyl-1-adamantyl)-4-methylpentan-1-amine
CID 79986867
1-(3,5-dimethyl-1-adamantyl)-2-methoxyethanamine
CID 79986402
[(3,5-dimethyl-1-adamantyl)-(1-methylimidazol-2-yl)methyl]hydrazine
CID 105250162
1-(1-methylcyclohexyl)prop-2-enylhydrazine
CID 106831272
[1-cyclobutyl-3-(3,5-dimethyl-1-adamantyl)propan-2-yl]hydrazine
CID 105310162
[1-(3,5-dimethyl-1-adamantyl)-3-methylbutan-2-yl]hydrazine
CID 105281772
(3S,5S)-3,5-dimethyladamantan-1-amine
CID 6604403
1-(3,5-dimethyl-1-adamantyl)-N-ethyl-2-methylbutan-1-amine
CID 79987248

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine?
The IUPAC name of 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine (CID 105250143) is 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine.
What is the SMILES notation for 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine?
The canonical SMILES for 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine is C=CC(NN)C12CC3CC(C)(CC(C)(C3)C1)C2.
What is the InChIKey of 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine?
The InChIKey is FVVVGKWBAQWNLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-4-12(17-16)15-7-11-5-13(2,9-15)8-14(3,6-11)10-15/h4,11-12,17H,1,5-10,16H2,2-3H3.
What are the key properties of 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine?
1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine has a molecular weight of 234.39 g/mol, XLogP of 3.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethyl-1-adamantyl)prop-2-enylhydrazine is sourced from PubChem (CID 105250143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).