[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine

C13H26N2 — CID 105224480

IUPAC[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine
SMILESCC1CCC(C(NN)C2CCC2)CC1C
InChIInChI=1S/C13H26N2/c1-9-6-7-12(8-10(9)2)13(15-14)11-4-3-5-11/h9-13,15H,3-8,14H2,1-2H3
InChIKeyXZEDROKAUNPVGD-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.69
Rot. Bonds3

About [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine

[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine (PubChem CID 105224480) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine
PubChem CID105224480
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine
SMILESCC1CCC(C(NN)C2CCC2)CC1C
InChIInChI=1S/C13H26N2/c1-9-6-7-12(8-10(9)2)13(15-14)11-4-3-5-11/h9-13,15H,3-8,14H2,1-2H3
InChIKeyXZEDROKAUNPVGD-UHFFFAOYSA-N
XLogP2.69
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', '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 [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine?
The IUPAC name of [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine (CID 105224480) is [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine is CC1CCC(C(NN)C2CCC2)CC1C.
What is the InChIKey of [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine?
The InChIKey is XZEDROKAUNPVGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-9-6-7-12(8-10(9)2)13(15-14)11-4-3-5-11/h9-13,15H,3-8,14H2,1-2H3.
What are the key properties of [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine?
[cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine has a molecular weight of 210.36 g/mol, XLogP of 2.69, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclobutyl-(3,4-dimethylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105224480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).