[1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine

C16H18ClFN2O — CID 105378015

IUPAC[1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCOc1cc(Cl)ccc1C(Cc1cc(F)ccc1C)NN
InChIInChI=1S/C16H18ClFN2O/c1-10-3-5-13(18)7-11(10)8-15(20-19)14-6-4-12(17)9-16(14)21-2/h3-7,9,15,20H,8,19H2,1-2H3
InChIKeyXNSRQNOQVYSLEQ-UHFFFAOYSA-N
MW308.78 g/mol
LogP3.54
Rot. Bonds5

About [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine

[1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine (PubChem CID 105378015) has the molecular formula C16H18ClFN2O and a molecular weight of 308.78 g/mol. Its IUPAC name is [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
PubChem CID105378015
Molecular FormulaC16H18ClFN2O
Molecular Weight308.78 g/mol
Exact Mass308.11
IUPAC Name[1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine
SMILESCOc1cc(Cl)ccc1C(Cc1cc(F)ccc1C)NN
InChIInChI=1S/C16H18ClFN2O/c1-10-3-5-13(18)7-11(10)8-15(20-19)14-6-4-12(17)9-16(14)21-2/h3-7,9,15,20H,8,19H2,1-2H3
InChIKeyXNSRQNOQVYSLEQ-UHFFFAOYSA-N
XLogP3.54
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.78
LogP ≤ 53.54
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-(5-fluoro-2-methylphenyl)-1-(2,3,4-trifluorophenyl)ethyl]hydrazine
CID 105378026
[2-(5-chloro-2-fluorophenyl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 103053488
1,2-bis(5-fluoro-2-methylphenyl)ethylhydrazine
CID 105377773
[2-(2-chloro-5-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 102623551
[2-(5-chloro-2-methoxyphenyl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 105297654
[1-(5-chloro-2-methylphenyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105291913
[2-(2-bromo-5-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 105297127
[2-(2,4-dichlorophenyl)-1-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105200119
[1-(2,5-dichlorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethyl]hydrazine
CID 105334244
[1-(5-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
CID 105280039
[2-(2,5-dichlorophenyl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 105191268
[2-(5-chloro-2-fluorophenyl)-1-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 103053830

Frequently Asked Questions

What is the IUPAC name of [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine (CID 105378015) is [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine is COc1cc(Cl)ccc1C(Cc1cc(F)ccc1C)NN.
What is the InChIKey of [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
The InChIKey is XNSRQNOQVYSLEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClFN2O/c1-10-3-5-13(18)7-11(10)8-15(20-19)14-6-4-12(17)9-16(14)21-2/h3-7,9,15,20H,8,19H2,1-2H3.
What are the key properties of [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine?
[1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine has a molecular weight of 308.78 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chloro-2-methoxyphenyl)-2-(5-fluoro-2-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105378015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).