[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine

C15H17BrN2O2 — CID 105192317

IUPAC[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(Br)cc2)cc1OC
InChIInChI=1S/C15H17BrN2O2/c1-19-13-8-5-11(9-14(13)20-2)15(18-17)10-3-6-12(16)7-4-10/h3-9,15,18H,17H2,1-2H3
InChIKeyLTHVLUWRIMPTSO-UHFFFAOYSA-N
MW337.22 g/mol
LogP3.02
Rot. Bonds5

About [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine

[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine (PubChem CID 105192317) has the molecular formula C15H17BrN2O2 and a molecular weight of 337.22 g/mol. Its IUPAC name is [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
PubChem CID105192317
Molecular FormulaC15H17BrN2O2
Molecular Weight337.22 g/mol
Exact Mass336.05
IUPAC Name[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
SMILESCOc1ccc(C(NN)c2ccc(Br)cc2)cc1OC
InChIInChI=1S/C15H17BrN2O2/c1-19-13-8-5-11(9-14(13)20-2)15(18-17)10-3-6-12(16)7-4-10/h3-9,15,18H,17H2,1-2H3
InChIKeyLTHVLUWRIMPTSO-UHFFFAOYSA-N
XLogP3.02
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.22
LogP ≤ 53.02
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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Related Compounds

[(3,5-dibromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 107979050
[(5-bromo-2-methylphenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105301110
[(3,4-dimethoxyphenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105192250
[(4-bromophenyl)-(5-fluoro-2-methoxyphenyl)methyl]hydrazine
CID 105192470
[(2-bromo-3-methylphenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 107986014
[(2,4-dichlorophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine
CID 105301093
[(5-bromo-2-methoxyphenyl)-(4-fluorophenyl)methyl]hydrazine
CID 112742212
[(3-bromo-5-methylphenyl)-(4-chloro-3-methoxyphenyl)methyl]hydrazine
CID 105320733
[(4-chloro-3-methoxyphenyl)-(4-methoxy-3-methylphenyl)methyl]hydrazine
CID 105258314
[(4-chloro-3-methoxyphenyl)-phenylmethyl]hydrazine
CID 105199196
[(3-bromo-4-methoxyphenyl)-(4-ethoxyphenyl)methyl]hydrazine
CID 105300768
[(4-bromophenyl)-(3,5-dimethylphenyl)methyl]hydrazine
CID 105192528

Frequently Asked Questions

What is the IUPAC name of [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
The IUPAC name of [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine (CID 105192317) is [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine is COc1ccc(C(NN)c2ccc(Br)cc2)cc1OC.
What is the InChIKey of [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
The InChIKey is LTHVLUWRIMPTSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O2/c1-19-13-8-5-11(9-14(13)20-2)15(18-17)10-3-6-12(16)7-4-10/h3-9,15,18H,17H2,1-2H3.
What are the key properties of [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine?
[(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine has a molecular weight of 337.22 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromophenyl)-(3,4-dimethoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105192317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).