5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline

C15H26ClN3 — CID 105224098

IUPAC5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline
SMILESCCCCC(CC)CC(NN)c1ccc(Cl)cc1N
InChIInChI=1S/C15H26ClN3/c1-3-5-6-11(4-2)9-15(19-18)13-8-7-12(16)10-14(13)17/h7-8,10-11,15,19H,3-6,9,17-18H2,1-2H3
InChIKeyIGLAGJTVBNINPY-UHFFFAOYSA-N
MW283.85 g/mol
LogP4.03
Rot. Bonds8

About 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline

5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline (PubChem CID 105224098) has the molecular formula C15H26ClN3 and a molecular weight of 283.85 g/mol. Its IUPAC name is 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline.

Molecular Properties

Compound Name5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline
PubChem CID105224098
Molecular FormulaC15H26ClN3
Molecular Weight283.85 g/mol
Exact Mass283.18
IUPAC Name5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline
SMILESCCCCC(CC)CC(NN)c1ccc(Cl)cc1N
InChIInChI=1S/C15H26ClN3/c1-3-5-6-11(4-2)9-15(19-18)13-8-7-12(16)10-14(13)17/h7-8,10-11,15,19H,3-6,9,17-18H2,1-2H3
InChIKeyIGLAGJTVBNINPY-UHFFFAOYSA-N
XLogP4.03
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.85
LogP ≤ 54.03
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-(4-bromo-2-fluorophenyl)-3-ethylheptyl]hydrazine
CID 105280875
5-chloro-2-(1-hydrazinyl-4-methylpentyl)aniline
CID 105224018
1-(5-chloro-2-methylphenyl)-3-ethyl-N-methylheptan-1-amine
CID 115806267
[1-(2-bromophenyl)-3-ethylheptyl]hydrazine
CID 105208587
[1-(2,5-dimethylfuran-3-yl)-3-ethylheptyl]hydrazine
CID 105288308
5-chloro-2-(1-hydrazinyl-2-methoxyethyl)aniline
CID 105224234
[1-(2,6-difluoro-3-methylphenyl)-3-ethylheptyl]hydrazine
CID 105288270
1-(4-chlorophenyl)-3-ethyl-N-methylheptan-1-amine
CID 55186033
[3-ethyl-1-(4-methylthiophen-3-yl)heptyl]hydrazine
CID 105251746
1-(2,4-dichlorophenyl)heptylhydrazine
CID 105293920
5-chloro-2-(1-hydrazinyl-2-methylbutyl)aniline
CID 105224215
[1-(3,5-dimethoxyphenyl)-3-ethylheptyl]hydrazine
CID 105288416

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline?
The IUPAC name of 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline (CID 105224098) is 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline.
What is the SMILES notation for 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline?
The canonical SMILES for 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline is CCCCC(CC)CC(NN)c1ccc(Cl)cc1N.
What is the InChIKey of 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline?
The InChIKey is IGLAGJTVBNINPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26ClN3/c1-3-5-6-11(4-2)9-15(19-18)13-8-7-12(16)10-14(13)17/h7-8,10-11,15,19H,3-6,9,17-18H2,1-2H3.
What are the key properties of 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline?
5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline has a molecular weight of 283.85 g/mol, XLogP of 4.03, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(3-ethyl-1-hydrazinylheptyl)aniline is sourced from PubChem (CID 105224098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).