4-fluoro-2-(1-hydrazinylundecyl)aniline

C17H30FN3 — CID 105263337

IUPAC4-fluoro-2-(1-hydrazinylundecyl)aniline
SMILESCCCCCCCCCCC(NN)c1cc(F)ccc1N
InChIInChI=1S/C17H30FN3/c1-2-3-4-5-6-7-8-9-10-17(21-20)15-13-14(18)11-12-16(15)19/h11-13,17,21H,2-10,19-20H2,1H3
InChIKeyABQXFGXOPMURBE-UHFFFAOYSA-N
MW295.45 g/mol
LogP4.44
Rot. Bonds11

About 4-fluoro-2-(1-hydrazinylundecyl)aniline

4-fluoro-2-(1-hydrazinylundecyl)aniline (PubChem CID 105263337) has the molecular formula C17H30FN3 and a molecular weight of 295.45 g/mol. Its IUPAC name is 4-fluoro-2-(1-hydrazinylundecyl)aniline.

Molecular Properties

Compound Name4-fluoro-2-(1-hydrazinylundecyl)aniline
PubChem CID105263337
Molecular FormulaC17H30FN3
Molecular Weight295.45 g/mol
Exact Mass295.24
IUPAC Name4-fluoro-2-(1-hydrazinylundecyl)aniline
SMILESCCCCCCCCCCC(NN)c1cc(F)ccc1N
InChIInChI=1S/C17H30FN3/c1-2-3-4-5-6-7-8-9-10-17(21-20)15-13-14(18)11-12-16(15)19/h11-13,17,21H,2-10,19-20H2,1H3
InChIKeyABQXFGXOPMURBE-UHFFFAOYSA-N
XLogP4.44
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 54.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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

4-fluoro-2-(1-hydrazinyldecyl)aniline
CID 105263176
1-(2-chloro-5-fluorophenyl)heptylhydrazine
CID 105398143
4-bromo-2-(1-hydrazinyloctyl)aniline
CID 105263445
4-fluoro-2-(1-hydrazinyloct-7-enyl)aniline
CID 107012619
1-(4-fluorophenyl)undecylhydrazine
CID 105192861
2-(1-hydrazinylpentyl)-4-(trifluoromethyl)aniline
CID 105264836
1-(2-fluorophenyl)dodecylhydrazine
CID 105292285
2-[(1R)-1-aminopentyl]-4-fluoroaniline;dihydrochloride
CID 162344534
1-(2-fluoro-4-methylphenyl)hexylhydrazine
CID 105294599
1-(2-fluoro-3-methylphenyl)undecylhydrazine
CID 105298411
1-(2-fluoro-3-methylphenyl)octylhydrazine
CID 105293647
1-(2-fluoro-4-methoxyphenyl)heptylhydrazine
CID 105256947

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-(1-hydrazinylundecyl)aniline?
The IUPAC name of 4-fluoro-2-(1-hydrazinylundecyl)aniline (CID 105263337) is 4-fluoro-2-(1-hydrazinylundecyl)aniline.
What is the SMILES notation for 4-fluoro-2-(1-hydrazinylundecyl)aniline?
The canonical SMILES for 4-fluoro-2-(1-hydrazinylundecyl)aniline is CCCCCCCCCCC(NN)c1cc(F)ccc1N.
What is the InChIKey of 4-fluoro-2-(1-hydrazinylundecyl)aniline?
The InChIKey is ABQXFGXOPMURBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30FN3/c1-2-3-4-5-6-7-8-9-10-17(21-20)15-13-14(18)11-12-16(15)19/h11-13,17,21H,2-10,19-20H2,1H3.
What are the key properties of 4-fluoro-2-(1-hydrazinylundecyl)aniline?
4-fluoro-2-(1-hydrazinylundecyl)aniline has a molecular weight of 295.45 g/mol, XLogP of 4.44, 11 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-(1-hydrazinylundecyl)aniline is sourced from PubChem (CID 105263337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).