[(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine

C13H22N2O — CID 105213645

IUPAC[(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine
SMILESCC1CC(C)CC(C(NN)c2ccco2)C1
InChIInChI=1S/C13H22N2O/c1-9-6-10(2)8-11(7-9)13(15-14)12-4-3-5-16-12/h3-5,9-11,13,15H,6-8,14H2,1-2H3
InChIKeyCAQNLQNCWQNZRW-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.86
Rot. Bonds3

About [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine

[(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine (PubChem CID 105213645) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine
PubChem CID105213645
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name[(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine
SMILESCC1CC(C)CC(C(NN)c2ccco2)C1
InChIInChI=1S/C13H22N2O/c1-9-6-10(2)8-11(7-9)13(15-14)12-4-3-5-16-12/h3-5,9-11,13,15H,6-8,14H2,1-2H3
InChIKeyCAQNLQNCWQNZRW-UHFFFAOYSA-N
XLogP2.86
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[furan-2-yl-(2-methylcyclopentyl)methyl]hydrazine
CID 107193917
[(1,1-dioxothiolan-3-yl)-(furan-2-yl)methyl]hydrazine
CID 105258764
N-[furan-2-yl-(3-methylcyclopentyl)methyl]ethanamine
CID 65413778
[(3,5-dimethylcyclohexyl)-(2,3-dimethylphenyl)methyl]hydrazine
CID 105312105
N-[1-(furan-2-yl)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64731661
[(2,3-dichlorophenyl)-(3,5-dimethylcyclohexyl)methyl]hydrazine
CID 105312173
[(3,5-dimethylcyclohexyl)-(4-ethylphenyl)methyl]hydrazine
CID 105197458
[(2,2-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine
CID 107193914
[1,4-dioxan-2-yl(furan-2-yl)methyl]hydrazine
CID 105305979
[(3,4-dimethoxyphenyl)-(3,5-dimethylcyclohexyl)methyl]hydrazine
CID 105192235
1-(3,5-dimethylcyclohexyl)-N-methyl-1-(2-methylfuran-3-yl)methanamine
CID 104789923
[(4-chloro-2-methoxyphenyl)-(3,5-dimethylcyclohexyl)methyl]hydrazine
CID 105312280

Frequently Asked Questions

What is the IUPAC name of [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine?
The IUPAC name of [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine (CID 105213645) is [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine?
The canonical SMILES for [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine is CC1CC(C)CC(C(NN)c2ccco2)C1.
What is the InChIKey of [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine?
The InChIKey is CAQNLQNCWQNZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-9-6-10(2)8-11(7-9)13(15-14)12-4-3-5-16-12/h3-5,9-11,13,15H,6-8,14H2,1-2H3.
What are the key properties of [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine?
[(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine has a molecular weight of 222.33 g/mol, XLogP of 2.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3,5-dimethylcyclohexyl)-(furan-2-yl)methyl]hydrazine is sourced from PubChem (CID 105213645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).