1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine

C12H23N3 — CID 105265825

IUPAC1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine
SMILESC=CCC(NN)C1CC2CCC(C1)N2C
InChIInChI=1S/C12H23N3/c1-3-4-12(14-13)9-7-10-5-6-11(8-9)15(10)2/h3,9-12,14H,1,4-8,13H2,2H3
InChIKeyYGTGAXYTGCIWHA-UHFFFAOYSA-N
MW209.34 g/mol
LogP1.27
Rot. Bonds4

About 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine

1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine (PubChem CID 105265825) has the molecular formula C12H23N3 and a molecular weight of 209.34 g/mol. Its IUPAC name is 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine.

Molecular Properties

Compound Name1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine
PubChem CID105265825
Molecular FormulaC12H23N3
Molecular Weight209.34 g/mol
Exact Mass209.19
IUPAC Name1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine
SMILESC=CCC(NN)C1CC2CCC(C1)N2C
InChIInChI=1S/C12H23N3/c1-3-4-12(14-13)9-7-10-5-6-11(8-9)15(10)2/h3,9-12,14H,1,4-8,13H2,2H3
InChIKeyYGTGAXYTGCIWHA-UHFFFAOYSA-N
XLogP1.27
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.34
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]hex-5-en-2-amine
CID 104655656
(3-Methyl-3-pyrrolidin-1-ylnon-8-en-4-yl)hydrazine
CID 105241038
(3-Methyl-3-piperidin-1-ylnon-8-en-4-yl)hydrazine
CID 105241267
(3-Ethyl-3-pyrrolidin-1-ylnon-8-en-4-yl)hydrazine
CID 105242104
1-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)pentylhydrazine
CID 105265678
[3-Methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine
CID 105265679
[4-Methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pentyl]hydrazine
CID 105265680
[2-Ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butyl]hydrazine
CID 105265681
1-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)hex-5-enylhydrazine
CID 105265711
1-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)butylhydrazine
CID 105265713
1-(8-Methyl-8-azabicyclo[3.2.1]octan-3-yl)prop-2-enylhydrazine
CID 105265714
[4-Methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-enyl]hydrazine
CID 105265773

Frequently Asked Questions

What is the IUPAC name of 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine?
The IUPAC name of 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine (CID 105265825) is 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine.
What is the SMILES notation for 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine?
The canonical SMILES for 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine is C=CCC(NN)C1CC2CCC(C1)N2C.
What is the InChIKey of 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine?
The InChIKey is YGTGAXYTGCIWHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3/c1-3-4-12(14-13)9-7-10-5-6-11(8-9)15(10)2/h3,9-12,14H,1,4-8,13H2,2H3.
What are the key properties of 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine?
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine has a molecular weight of 209.34 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)but-3-enylhydrazine is sourced from PubChem (CID 105265825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).