5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline

C13H11F2NO — CID 82537168

IUPAC5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline
SMILESCOc1ccc(F)cc1Nc1cccc(F)c1
InChIInChI=1S/C13H11F2NO/c1-17-13-6-5-10(15)8-12(13)16-11-4-2-3-9(14)7-11/h2-8,16H,1H3
InChIKeyHDTKJGYYBDHJGI-UHFFFAOYSA-N
MW235.23 g/mol
LogP3.72
Rot. Bonds3

About 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline

5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline (PubChem CID 82537168) has the molecular formula C13H11F2NO and a molecular weight of 235.23 g/mol. Its IUPAC name is 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline.

Molecular Properties

Compound Name5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline
PubChem CID82537168
Molecular FormulaC13H11F2NO
Molecular Weight235.23 g/mol
Exact Mass235.08
IUPAC Name5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline
SMILESCOc1ccc(F)cc1Nc1cccc(F)c1
InChIInChI=1S/C13H11F2NO/c1-17-13-6-5-10(15)8-12(13)16-11-4-2-3-9(14)7-11/h2-8,16H,1H3
InChIKeyHDTKJGYYBDHJGI-UHFFFAOYSA-N
XLogP3.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.23
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-fluoro-2-methoxy-N-(3-methoxyphenyl)aniline
CID 82537043
5-fluoro-N-(4-fluorophenyl)-2-methoxyaniline
CID 82537214
3,4-difluoro-N-(5-fluoro-2-methoxyphenyl)aniline
CID 82536880
N-(5-fluoro-2-methoxyphenyl)pyridin-3-amine
CID 82537505
3-chloro-4-fluoro-N-(5-fluoro-2-methoxyphenyl)aniline
CID 82536190
1-N,3-N-bis(2-methoxyphenyl)benzene-1,3-diamine
CID 19024304
3-fluoro-N-(3-fluorophenyl)-2-methoxyaniline
CID 175464323
6-N-(3-fluorophenyl)-4-N-(2-methoxyphenyl)-2-methylpyrimidine-4,6-diamine
CID 112878300
1-[4-(5-fluoro-2-methoxyanilino)phenyl]ethanone
CID 82536658
5-chloro-N-(3-chlorophenyl)-2-methoxyaniline
CID 82536935
3-(2-methoxyanilino)phenol
CID 82537348
3-fluoro-N-(4-fluorophenyl)aniline
CID 54316192

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline?
The IUPAC name of 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline (CID 82537168) is 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline.
What is the SMILES notation for 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline?
The canonical SMILES for 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline is COc1ccc(F)cc1Nc1cccc(F)c1.
What is the InChIKey of 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline?
The InChIKey is HDTKJGYYBDHJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2NO/c1-17-13-6-5-10(15)8-12(13)16-11-4-2-3-9(14)7-11/h2-8,16H,1H3.
What are the key properties of 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline?
5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline has a molecular weight of 235.23 g/mol, XLogP of 3.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(3-fluorophenyl)-2-methoxyaniline is sourced from PubChem (CID 82537168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).