[1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine

C16H18Br2N2O — CID 105195433

IUPAC[1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine
SMILESCOc1ccc(CC(Cc2ccc(Br)cc2)NN)cc1Br
InChIInChI=1S/C16H18Br2N2O/c1-21-16-7-4-12(10-15(16)18)9-14(20-19)8-11-2-5-13(17)6-3-11/h2-7,10,14,20H,8-9,19H2,1H3
InChIKeyVWWRNLIOGPWDCI-UHFFFAOYSA-N
MW414.14 g/mol
LogP3.84
Rot. Bonds6

About [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine

[1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine (PubChem CID 105195433) has the molecular formula C16H18Br2N2O and a molecular weight of 414.14 g/mol. Its IUPAC name is [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine
PubChem CID105195433
Molecular FormulaC16H18Br2N2O
Molecular Weight414.14 g/mol
Exact Mass411.98
IUPAC Name[1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine
SMILESCOc1ccc(CC(Cc2ccc(Br)cc2)NN)cc1Br
InChIInChI=1S/C16H18Br2N2O/c1-21-16-7-4-12(10-15(16)18)9-14(20-19)8-11-2-5-13(17)6-3-11/h2-7,10,14,20H,8-9,19H2,1H3
InChIKeyVWWRNLIOGPWDCI-UHFFFAOYSA-N
XLogP3.84
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.14
LogP ≤ 53.84
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

[1-(3-bromo-4-methoxyphenyl)-3-methylsulfonylpropan-2-yl]hydrazine
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3-(3-bromo-4-methoxyphenyl)-2-(4-bromophenyl)propan-1-amine
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[1-(5-bromo-2-chlorophenyl)-2-(3-bromo-4-methoxyphenyl)ethyl]hydrazine
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1-(3-bromo-4-methoxyphenyl)-3-ethyl-2-hydrazinyl-N,N-dimethylpentan-3-amine
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1-(3-bromo-4-methoxyphenyl)-2-(4-bromophenyl)-N-methylethanamine
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2-(3-bromo-4-methoxyphenyl)-1-(3,5-dibromophenyl)ethanamine
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[2-(3-bromo-4-methoxyphenyl)-1-(5-bromothiophen-2-yl)ethyl]hydrazine
CID 105222004
[2-(3-bromo-4-methoxyphenyl)-1-(2,6-dimethyl-4-pyridinyl)ethyl]hydrazine
CID 107504894
4-bromo-N-[(3-bromo-4-methoxyphenyl)methyl]aniline
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Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine?
The IUPAC name of [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine (CID 105195433) is [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine is COc1ccc(CC(Cc2ccc(Br)cc2)NN)cc1Br.
What is the InChIKey of [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine?
The InChIKey is VWWRNLIOGPWDCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Br2N2O/c1-21-16-7-4-12(10-15(16)18)9-14(20-19)8-11-2-5-13(17)6-3-11/h2-7,10,14,20H,8-9,19H2,1H3.
What are the key properties of [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine?
[1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine has a molecular weight of 414.14 g/mol, XLogP of 3.84, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-4-methoxyphenyl)-3-(4-bromophenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105195433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).