5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline

C14H14Cl3N3 — CID 105224259

IUPAC5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline
SMILESNNC(Cc1cc(Cl)ccc1Cl)c1ccc(Cl)cc1N
InChIInChI=1S/C14H14Cl3N3/c15-9-2-4-12(17)8(5-9)6-14(20-19)11-3-1-10(16)7-13(11)18/h1-5,7,14,20H,6,18-19H2
InChIKeyWIJNZTZSOMVHKX-UHFFFAOYSA-N
MW330.65 g/mol
LogP3.98
Rot. Bonds4

About 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline

5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline (PubChem CID 105224259) has the molecular formula C14H14Cl3N3 and a molecular weight of 330.65 g/mol. Its IUPAC name is 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline.

Molecular Properties

Compound Name5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline
PubChem CID105224259
Molecular FormulaC14H14Cl3N3
Molecular Weight330.65 g/mol
Exact Mass329.03
IUPAC Name5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline
SMILESNNC(Cc1cc(Cl)ccc1Cl)c1ccc(Cl)cc1N
InChIInChI=1S/C14H14Cl3N3/c15-9-2-4-12(17)8(5-9)6-14(20-19)11-3-1-10(16)7-13(11)18/h1-5,7,14,20H,6,18-19H2
InChIKeyWIJNZTZSOMVHKX-UHFFFAOYSA-N
XLogP3.98
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.65
LogP ≤ 53.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 105280226
[1-(4-chloro-2,5-difluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 105309874
[2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethyl]hydrazine
CID 105309863
[2-(2,5-dichlorophenyl)-1-(2-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105309794
[1-(3-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 105223470
1,2-bis(2,4-dichlorophenyl)ethylhydrazine
CID 105295029
[2-(2,5-dichlorophenyl)-1-(2-methoxyphenyl)ethyl]hydrazine
CID 105191268
5-chloro-2-(1-hydrazinyl-4-methylpentyl)aniline
CID 105224018
[1-(4-bromophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 105192530
[1-(4-chloro-3-fluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 107997063
5-chloro-2-(1-hydrazinyl-2-methoxyethyl)aniline
CID 105224234
[2-(2,5-dichlorophenyl)-1-(4-ethoxyphenyl)ethyl]hydrazine
CID 105309809

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline?
The IUPAC name of 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline (CID 105224259) is 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline.
What is the SMILES notation for 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline?
The canonical SMILES for 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline is NNC(Cc1cc(Cl)ccc1Cl)c1ccc(Cl)cc1N.
What is the InChIKey of 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline?
The InChIKey is WIJNZTZSOMVHKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl3N3/c15-9-2-4-12(17)8(5-9)6-14(20-19)11-3-1-10(16)7-13(11)18/h1-5,7,14,20H,6,18-19H2.
What are the key properties of 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline?
5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline has a molecular weight of 330.65 g/mol, XLogP of 3.98, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[2-(2,5-dichlorophenyl)-1-hydrazinylethyl]aniline is sourced from PubChem (CID 105224259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).