[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine

C16H18ClFN2 — CID 105218179

IUPAC[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
SMILESCc1cccc(C)c1CC(NN)c1ccc(F)c(Cl)c1
InChIInChI=1S/C16H18ClFN2/c1-10-4-3-5-11(2)13(10)9-16(20-19)12-6-7-15(18)14(17)8-12/h3-8,16,20H,9,19H2,1-2H3
InChIKeyYHMLKUSZKYOUIV-UHFFFAOYSA-N
MW292.79 g/mol
LogP3.84
Rot. Bonds4

About [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine

[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine (PubChem CID 105218179) has the molecular formula C16H18ClFN2 and a molecular weight of 292.79 g/mol. Its IUPAC name is [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
PubChem CID105218179
Molecular FormulaC16H18ClFN2
Molecular Weight292.79 g/mol
Exact Mass292.11
IUPAC Name[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
SMILESCc1cccc(C)c1CC(NN)c1ccc(F)c(Cl)c1
InChIInChI=1S/C16H18ClFN2/c1-10-4-3-5-11(2)13(10)9-16(20-19)12-6-7-15(18)14(17)8-12/h3-8,16,20H,9,19H2,1-2H3
InChIKeyYHMLKUSZKYOUIV-UHFFFAOYSA-N
XLogP3.84
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.79
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105264141
[2-(2,6-difluorophenyl)-1-(4-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105204208
1-(4-chloro-3-fluorophenyl)-2-(2,6-dimethylphenyl)-N-methylethanamine
CID 107994783
1-(3-chloro-4-fluorophenyl)-2-(2,6-dichlorophenyl)-N-methylethanamine
CID 63418484
[1-(4-bromo-3-chlorophenyl)-2-(2,6-difluorophenyl)ethyl]hydrazine
CID 105342880
[2-(2-chloro-6-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethyl]hydrazine
CID 105258266
1-(3-chloro-4-fluorophenyl)decylhydrazine
CID 105218123
[1-(3-chloro-4-fluorophenyl)-4,4-dimethylpentyl]hydrazine
CID 105218176
[1-(2,4-difluoro-5-methylphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329197
[1-(3-bromo-4-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105264214
[2-(2,6-dimethylphenyl)-1-(4-ethylphenyl)ethyl]hydrazine
CID 105197416
[1-(3-bromo-4-methoxyphenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine
CID 105329211

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine (CID 105218179) is [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine is Cc1cccc(C)c1CC(NN)c1ccc(F)c(Cl)c1.
What is the InChIKey of [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
The InChIKey is YHMLKUSZKYOUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClFN2/c1-10-4-3-5-11(2)13(10)9-16(20-19)12-6-7-15(18)14(17)8-12/h3-8,16,20H,9,19H2,1-2H3.
What are the key properties of [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine?
[1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine has a molecular weight of 292.79 g/mol, XLogP of 3.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-fluorophenyl)-2-(2,6-dimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105218179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).