[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine

C17H21BrN2O — CID 105326074

IUPAC[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCc1cc(Br)ccc1C(NN)c1ccccc1OC(C)C
InChIInChI=1S/C17H21BrN2O/c1-11(2)21-16-7-5-4-6-15(16)17(20-19)14-9-8-13(18)10-12(14)3/h4-11,17,20H,19H2,1-3H3
InChIKeyZWHLGTYDZODRSI-UHFFFAOYSA-N
MW349.27 g/mol
LogP4.10
Rot. Bonds5

About [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine

[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine (PubChem CID 105326074) has the molecular formula C17H21BrN2O and a molecular weight of 349.27 g/mol. Its IUPAC name is [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
PubChem CID105326074
Molecular FormulaC17H21BrN2O
Molecular Weight349.27 g/mol
Exact Mass348.08
IUPAC Name[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
SMILESCc1cc(Br)ccc1C(NN)c1ccccc1OC(C)C
InChIInChI=1S/C17H21BrN2O/c1-11(2)21-16-7-5-4-6-15(16)17(20-19)14-9-8-13(18)10-12(14)3/h4-11,17,20H,19H2,1-3H3
InChIKeyZWHLGTYDZODRSI-UHFFFAOYSA-N
XLogP4.10
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.27
LogP ≤ 54.10
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

[(2-bromo-4-chlorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107997211
[(2,5-dibromothiophen-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 107970496
[[2-(difluoromethoxy)phenyl]-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105302409
[(2,5-dimethylfuran-3-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326122
[(2-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105216890
1-(2,5-dibromophenyl)-N-methyl-1-(2-propan-2-yloxyphenyl)methanamine
CID 105018419
[(4-bromo-2-methylphenyl)-isoquinolin-4-ylmethyl]hydrazine
CID 105306340
[(2,3-dichlorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326117
[(4-bromo-3-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105326153
[(4-fluorophenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105192765
[(5-methylpyrimidin-2-yl)-(2-propan-2-yloxyphenyl)methyl]hydrazine
CID 105261588
[(4-bromo-2-methylphenyl)-(2-chloro-5-fluorophenyl)methyl]hydrazine
CID 105398119

Frequently Asked Questions

What is the IUPAC name of [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
The IUPAC name of [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine (CID 105326074) is [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine is Cc1cc(Br)ccc1C(NN)c1ccccc1OC(C)C.
What is the InChIKey of [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
The InChIKey is ZWHLGTYDZODRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21BrN2O/c1-11(2)21-16-7-5-4-6-15(16)17(20-19)14-9-8-13(18)10-12(14)3/h4-11,17,20H,19H2,1-3H3.
What are the key properties of [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine?
[(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine has a molecular weight of 349.27 g/mol, XLogP of 4.10, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-2-methylphenyl)-(2-propan-2-yloxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105326074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).