[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine

C17H22N2O — CID 105191931

IUPAC[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1cccc(C(NN)c2ccc(C)cc2C)c1
InChIInChI=1S/C17H22N2O/c1-4-20-15-7-5-6-14(11-15)17(19-18)16-9-8-12(2)10-13(16)3/h5-11,17,19H,4,18H2,1-3H3
InChIKeyKRNMZTNLZKPGKD-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.25
Rot. Bonds5

About [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine

[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine (PubChem CID 105191931) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine
PubChem CID105191931
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine
SMILESCCOc1cccc(C(NN)c2ccc(C)cc2C)c1
InChIInChI=1S/C17H22N2O/c1-4-20-15-7-5-6-14(11-15)17(19-18)16-9-8-12(2)10-13(16)3/h5-11,17,19H,4,18H2,1-3H3
InChIKeyKRNMZTNLZKPGKD-UHFFFAOYSA-N
XLogP3.25
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.25
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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Frequently Asked Questions

What is the IUPAC name of [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine (CID 105191931) is [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine is CCOc1cccc(C(NN)c2ccc(C)cc2C)c1.
What is the InChIKey of [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine?
The InChIKey is KRNMZTNLZKPGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-4-20-15-7-5-6-14(11-15)17(19-18)16-9-8-12(2)10-13(16)3/h5-11,17,19H,4,18H2,1-3H3.
What are the key properties of [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine?
[(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine has a molecular weight of 270.38 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2,4-dimethylphenyl)-(3-ethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105191931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).