1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine

C13H27N3 — CID 105243900

IUPAC1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine
SMILESC=C(C)C(NN)C1(N(C)C)CCCCCC1
InChIInChI=1S/C13H27N3/c1-11(2)12(15-14)13(16(3)4)9-7-5-6-8-10-13/h12,15H,1,5-10,14H2,2-4H3
InChIKeyRFGOSOUXFDIWIR-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.05
Rot. Bonds4

About 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine

1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine (PubChem CID 105243900) has the molecular formula C13H27N3 and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine.

Molecular Properties

Compound Name1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine
PubChem CID105243900
Molecular FormulaC13H27N3
Molecular Weight225.38 g/mol
Exact Mass225.22
IUPAC Name1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine
SMILESC=C(C)C(NN)C1(N(C)C)CCCCCC1
InChIInChI=1S/C13H27N3/c1-11(2)12(15-14)13(16(3)4)9-7-5-6-8-10-13/h12,15H,1,5-10,14H2,2-4H3
InChIKeyRFGOSOUXFDIWIR-UHFFFAOYSA-N
XLogP2.05
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.05
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

1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N,4-trimethylcyclohexan-1-amine
CID 105243542
[1-(1-methoxycycloheptyl)-2-methylprop-2-enyl]hydrazine
CID 105278319
[1-(1-ethylcyclopentyl)-2-methylprop-2-enyl]hydrazine
CID 105320113
[2-methyl-1-(1-piperidin-1-ylcyclopentyl)prop-2-enyl]hydrazine
CID 105243022
1-(1-amino-3-methylbut-3-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79185474
[1-(1-ethoxycyclopentyl)-2-methylprop-2-enyl]hydrazine
CID 105275840
1-[1-(ethylamino)-3-methylbut-3-enyl]-N,N-dimethylcyclohexan-1-amine
CID 79184871
1-(1-aminoethyl)-N,N-dimethylcycloheptan-1-amine
CID 79081577
1-(1-amino-3-methylbut-2-enyl)-N,N-dimethylcycloheptan-1-amine
CID 79178641
1-(2-cyclohexyl-1-hydrazinylethyl)-N,N-dimethylcycloheptan-1-amine
CID 105243794
1-[hydrazinyl-(4-methylphenyl)methyl]-N,N-dimethylcycloheptan-1-amine
CID 105243774
1-[hydrazinyl-(4-methylphenyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 105243191

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine?
The IUPAC name of 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine (CID 105243900) is 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine.
What is the SMILES notation for 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine?
The canonical SMILES for 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine is C=C(C)C(NN)C1(N(C)C)CCCCCC1.
What is the InChIKey of 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine?
The InChIKey is RFGOSOUXFDIWIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3/c1-11(2)12(15-14)13(16(3)4)9-7-5-6-8-10-13/h12,15H,1,5-10,14H2,2-4H3.
What are the key properties of 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine?
1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydrazinyl-2-methylprop-2-enyl)-N,N-dimethylcycloheptan-1-amine is sourced from PubChem (CID 105243900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).