[1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine

C15H15BrClFN2O — CID 105289117

IUPAC[1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
SMILESCOc1cc(Br)ccc1C(Cc1c(F)cccc1Cl)NN
InChIInChI=1S/C15H15BrClFN2O/c1-21-15-7-9(16)5-6-10(15)14(20-19)8-11-12(17)3-2-4-13(11)18/h2-7,14,20H,8,19H2,1H3
InChIKeyHKKPNVDKMUWZHC-UHFFFAOYSA-N
MW373.65 g/mol
LogP4.00
Rot. Bonds5

About [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine

[1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine (PubChem CID 105289117) has the molecular formula C15H15BrClFN2O and a molecular weight of 373.65 g/mol. Its IUPAC name is [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
PubChem CID105289117
Molecular FormulaC15H15BrClFN2O
Molecular Weight373.65 g/mol
Exact Mass372.00
IUPAC Name[1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
SMILESCOc1cc(Br)ccc1C(Cc1c(F)cccc1Cl)NN
InChIInChI=1S/C15H15BrClFN2O/c1-21-15-7-9(16)5-6-10(15)14(20-19)8-11-12(17)3-2-4-13(11)18/h2-7,14,20H,8,19H2,1H3
InChIKeyHKKPNVDKMUWZHC-UHFFFAOYSA-N
XLogP4.00
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.65
LogP ≤ 54.00
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-(4-bromo-2-methoxyphenyl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 115830255
[2-(2-chloro-6-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252351
[2-(2-chloro-6-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine
CID 105258266
1-(4-bromo-2-methoxyphenyl)-2-(2,6-dichlorophenyl)ethanol
CID 115782457
[1-(2-bromo-4-methylphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
CID 105289027
1-(5-bromo-2-methoxyphenyl)-3-(2-chloro-6-fluorophenyl)propan-2-amine
CID 63024382
[1-(3-bromo-2-fluorophenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
CID 106648844
[1-(4-bromo-2-methoxyphenyl)-2-(5-chlorothiophen-2-yl)ethyl]hydrazine
CID 105296071
[1-(4-bromo-2-fluorophenyl)-2-(2-methoxyphenyl)ethyl]hydrazine
CID 105281069
1-(5-bromo-2-fluorophenyl)-2-(2-chloro-6-fluorophenyl)ethanol
CID 63017670
[1-(5-bromo-2-chlorophenyl)-2-(3-fluoro-4-methoxyphenyl)ethyl]hydrazine
CID 105292972
[2-(2-bromo-3-fluorophenyl)-1-(5-chloro-2-methoxyphenyl)ethyl]hydrazine
CID 105327100

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine (CID 105289117) is [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine is COc1cc(Br)ccc1C(Cc1c(F)cccc1Cl)NN.
What is the InChIKey of [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine?
The InChIKey is HKKPNVDKMUWZHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClFN2O/c1-21-15-7-9(16)5-6-10(15)14(20-19)8-11-12(17)3-2-4-13(11)18/h2-7,14,20H,8,19H2,1H3.
What are the key properties of [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine?
[1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine has a molecular weight of 373.65 g/mol, XLogP of 4.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-2-methoxyphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 105289117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).