[2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine

C16H18ClFN2O — CID 102623414

IUPAC[2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cc(F)ccc2Cl)NN)cc1C
InChIInChI=1S/C16H18ClFN2O/c1-10-7-11(3-6-16(10)21-2)15(20-19)9-12-8-13(18)4-5-14(12)17/h3-8,15,20H,9,19H2,1-2H3
InChIKeyCCZWSIMZLVNLST-UHFFFAOYSA-N
MW308.78 g/mol
LogP3.54
Rot. Bonds5

About [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine

[2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine (PubChem CID 102623414) has the molecular formula C16H18ClFN2O and a molecular weight of 308.78 g/mol. Its IUPAC name is [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine
PubChem CID102623414
Molecular FormulaC16H18ClFN2O
Molecular Weight308.78 g/mol
Exact Mass308.11
IUPAC Name[2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine
SMILESCOc1ccc(C(Cc2cc(F)ccc2Cl)NN)cc1C
InChIInChI=1S/C16H18ClFN2O/c1-10-7-11(3-6-16(10)21-2)15(20-19)9-12-8-13(18)4-5-14(12)17/h3-8,15,20H,9,19H2,1-2H3
InChIKeyCCZWSIMZLVNLST-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

[1-(4-chloro-3-methylphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
CID 105288871
[2-(2-chloro-6-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine
CID 105258266
[1-(3-bromo-4-methoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340895
[1-(4-fluoro-3-methoxyphenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105340825
[2-(2-chloro-5-fluorophenyl)-1-pyridin-3-ylethyl]hydrazine
CID 102623237
[1-(3-bromo-4-methoxyphenyl)-2-(2,5-difluorophenyl)ethyl]hydrazine
CID 105288951
[1-(4-chloro-3-methoxyphenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105320864
[2-(2-chloro-4-fluorophenyl)-1-(4-methoxyphenyl)ethyl]hydrazine
CID 105190734
[2-(2-chloro-5-fluorophenyl)-1-(5-chloro-2-methylphenyl)ethyl]hydrazine
CID 102623551
[1-(2-chloro-5-fluorophenyl)-3-(2-methoxyphenyl)propan-2-yl]hydrazine
CID 102623265
[1-(3-chloro-4-iodophenyl)-2-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 103217826
2-(3-chloro-2-fluorophenyl)-1-(4-methoxy-3-methylphenyl)-N-methylethanamine
CID 102857856

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine (CID 102623414) is [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine is COc1ccc(C(Cc2cc(F)ccc2Cl)NN)cc1C.
What is the InChIKey of [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine?
The InChIKey is CCZWSIMZLVNLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClFN2O/c1-10-7-11(3-6-16(10)21-2)15(20-19)9-12-8-13(18)4-5-14(12)17/h3-8,15,20H,9,19H2,1-2H3.
What are the key properties of [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine?
[2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-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 [2-(2-chloro-5-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine is sourced from PubChem (CID 102623414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).