[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine

C18H24N2O — CID 105271982

IUPAC[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine
SMILESCOC(C(C)C)C(NN)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H24N2O/c1-13(2)18(21-3)17(20-19)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13,17-18,20H,19H2,1-3H3
InChIKeyUIJGXWZMWWKWIC-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.53
Rot. Bonds6

About [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine

[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine (PubChem CID 105271982) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine.

Molecular Properties

Compound Name[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine
PubChem CID105271982
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine
SMILESCOC(C(C)C)C(NN)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H24N2O/c1-13(2)18(21-3)17(20-19)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13,17-18,20H,19H2,1-3H3
InChIKeyUIJGXWZMWWKWIC-UHFFFAOYSA-N
XLogP3.53
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.53
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-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
The IUPAC name of [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine (CID 105271982) is [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine.
What is the SMILES notation for [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
The canonical SMILES for [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine is COC(C(C)C)C(NN)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
The InChIKey is UIJGXWZMWWKWIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-13(2)18(21-3)17(20-19)16-11-9-15(10-12-16)14-7-5-4-6-8-14/h4-13,17-18,20H,19H2,1-3H3.
What are the key properties of [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine?
[2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine has a molecular weight of 284.40 g/mol, XLogP of 3.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-3-methyl-1-(4-phenylphenyl)butyl]hydrazine is sourced from PubChem (CID 105271982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).