[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine

C17H28N2O2 — CID 105231871

IUPAC[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)C2CCC(C)(C)CC2)c(OC)c1
InChIInChI=1S/C17H28N2O2/c1-17(2)9-7-12(8-10-17)16(19-18)14-6-5-13(20-3)11-15(14)21-4/h5-6,11-12,16,19H,7-10,18H2,1-4H3
InChIKeyORJPGCOVVMCGFR-UHFFFAOYSA-N
MW292.42 g/mol
LogP3.42
Rot. Bonds5

About [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine

[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine (PubChem CID 105231871) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine
PubChem CID105231871
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)C2CCC(C)(C)CC2)c(OC)c1
InChIInChI=1S/C17H28N2O2/c1-17(2)9-7-12(8-10-17)16(19-18)14-6-5-13(20-3)11-15(14)21-4/h5-6,11-12,16,19H,7-10,18H2,1-4H3
InChIKeyORJPGCOVVMCGFR-UHFFFAOYSA-N
XLogP3.42
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine (CID 105231871) is [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine is COc1ccc(C(NN)C2CCC(C)(C)CC2)c(OC)c1.
What is the InChIKey of [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine?
The InChIKey is ORJPGCOVVMCGFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-17(2)9-7-12(8-10-17)16(19-18)14-6-5-13(20-3)11-15(14)21-4/h5-6,11-12,16,19H,7-10,18H2,1-4H3.
What are the key properties of [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine?
[(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine has a molecular weight of 292.42 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dimethoxyphenyl)-(4,4-dimethylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105231871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).