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

C17H20ClFN2 — CID 105292719

IUPAC[1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)c(CC(NN)c2cccc(F)c2Cl)c(C)c1
InChIInChI=1S/C17H20ClFN2/c1-10-7-11(2)14(12(3)8-10)9-16(21-20)13-5-4-6-15(19)17(13)18/h4-8,16,21H,9,20H2,1-3H3
InChIKeyQIDWLFJGPIVPIS-UHFFFAOYSA-N
MW306.81 g/mol
LogP4.15
Rot. Bonds4

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

[1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine (PubChem CID 105292719) has the molecular formula C17H20ClFN2 and a molecular weight of 306.81 g/mol. Its IUPAC name is [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
PubChem CID105292719
Molecular FormulaC17H20ClFN2
Molecular Weight306.81 g/mol
Exact Mass306.13
IUPAC Name[1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
SMILESCc1cc(C)c(CC(NN)c2cccc(F)c2Cl)c(C)c1
InChIInChI=1S/C17H20ClFN2/c1-10-7-11(2)14(12(3)8-10)9-16(21-20)13-5-4-6-15(19)17(13)18/h4-8,16,21H,9,20H2,1-3H3
InChIKeyQIDWLFJGPIVPIS-UHFFFAOYSA-N
XLogP4.15
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.81
LogP ≤ 54.15
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-(2-chloro-3-methylphenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105292752
[1-(2-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105216946
[1-(3-chloro-2-methylphenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 107103616
[1-(2-bromophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105208762
[1-(2,5-dichlorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine
CID 105292704
2-[1-hydrazinyl-2-(2,4,6-trimethylphenyl)ethyl]aniline
CID 105223956
N-ethyl-1-(2-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethanamine
CID 63417518
[1-(2-chloro-3-methylphenyl)-2-(3,5-dimethylphenyl)ethyl]hydrazine
CID 105287257
[2-(5-bromo-2-fluorophenyl)-1-(2-chloro-3-fluorophenyl)ethyl]hydrazine
CID 105294924
[1-(2-bromo-4-methylphenyl)-2-(2-chloro-6-fluorophenyl)ethyl]hydrazine
CID 105289027
[2-(2,6-difluorophenyl)-1-(2-fluoro-4-methylphenyl)ethyl]hydrazine
CID 105342843
[1-(2-chloro-3-fluorophenyl)-3-ethylpentyl]hydrazine
CID 105331064

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The IUPAC name of [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine (CID 105292719) is [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The canonical SMILES for [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine is Cc1cc(C)c(CC(NN)c2cccc(F)c2Cl)c(C)c1.
What is the InChIKey of [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
The InChIKey is QIDWLFJGPIVPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClFN2/c1-10-7-11(2)14(12(3)8-10)9-16(21-20)13-5-4-6-15(19)17(13)18/h4-8,16,21H,9,20H2,1-3H3.
What are the key properties of [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine?
[1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine has a molecular weight of 306.81 g/mol, XLogP of 4.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-3-fluorophenyl)-2-(2,4,6-trimethylphenyl)ethyl]hydrazine is sourced from PubChem (CID 105292719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).