[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine

C18H24N2O — CID 105190992

IUPAC[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(C(C)(C)C)cc2)cc1
InChIInChI=1S/C18H24N2O/c1-18(2,3)15-9-5-13(6-10-15)17(20-19)14-7-11-16(21-4)12-8-14/h5-12,17,20H,19H2,1-4H3
InChIKeyXAUACOHCZMYOOW-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.55
Rot. Bonds4

About [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine

[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine (PubChem CID 105190992) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine
PubChem CID105190992
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(C(C)(C)C)cc2)cc1
InChIInChI=1S/C18H24N2O/c1-18(2,3)15-9-5-13(6-10-15)17(20-19)14-7-11-16(21-4)12-8-14/h5-12,17,20H,19H2,1-4H3
InChIKeyXAUACOHCZMYOOW-UHFFFAOYSA-N
XLogP3.55
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.55
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 [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine (CID 105190992) is [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine is COc1ccc(C(NN)c2ccc(C(C)(C)C)cc2)cc1.
What is the InChIKey of [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine?
The InChIKey is XAUACOHCZMYOOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-18(2,3)15-9-5-13(6-10-15)17(20-19)14-7-11-16(21-4)12-8-14/h5-12,17,20H,19H2,1-4H3.
What are the key properties of [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine?
[(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine has a molecular weight of 284.40 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylphenyl)-(4-methoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105190992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).