2,4-difluoro-N-(2-methoxyphenyl)aniline

C13H11F2NO — CID 82537085

IUPAC2,4-difluoro-N-(2-methoxyphenyl)aniline
SMILESCOc1ccccc1Nc1ccc(F)cc1F
InChIInChI=1S/C13H11F2NO/c1-17-13-5-3-2-4-12(13)16-11-7-6-9(14)8-10(11)15/h2-8,16H,1H3
InChIKeyNTYSQIPPOBBOGM-UHFFFAOYSA-N
MW235.23 g/mol
LogP3.72
Rot. Bonds3

About 2,4-difluoro-N-(2-methoxyphenyl)aniline

2,4-difluoro-N-(2-methoxyphenyl)aniline (PubChem CID 82537085) has the molecular formula C13H11F2NO and a molecular weight of 235.23 g/mol. Its IUPAC name is 2,4-difluoro-N-(2-methoxyphenyl)aniline.

Molecular Properties

Compound Name2,4-difluoro-N-(2-methoxyphenyl)aniline
PubChem CID82537085
Molecular FormulaC13H11F2NO
Molecular Weight235.23 g/mol
Exact Mass235.08
IUPAC Name2,4-difluoro-N-(2-methoxyphenyl)aniline
SMILESCOc1ccccc1Nc1ccc(F)cc1F
InChIInChI=1S/C13H11F2NO/c1-17-13-5-3-2-4-12(13)16-11-7-6-9(14)8-10(11)15/h2-8,16H,1H3
InChIKeyNTYSQIPPOBBOGM-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

4-chloro-2-methoxy-N-(2-methoxyphenyl)aniline
CID 10038418
5-(2,4-difluoroanilino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109199705
5-chloro-2-methoxy-N-(2-methoxyphenyl)aniline
CID 10264756
2-methoxy-N-phenylaniline
CID 10910514
N-(2,4-difluorophenyl)-3-(2-methoxyanilino)propanamide
CID 109039452
(2S)-N-(2,4-difluorophenyl)-2-(2-methoxyanilino)propanamide
CID 9274019
6-(2,4-difluoroanilino)-N-(2-methoxyphenyl)-2-methylpyrimidine-4-carboxamide
CID 112850469
N-(2,4-difluorophenyl)-2-(2-methoxyanilino)pyrimidine-4-carboxamide
CID 109317538
5-fluoro-N-(4-fluorophenyl)-2-methoxyaniline
CID 82537214
1-N-(2-fluorophenyl)-3-methoxybenzene-1,2-diamine
CID 113392493
4-bromo-5-fluoro-1-N-(4-fluoro-2-methoxyphenyl)benzene-1,2-diamine
CID 66111706
1-N,3-N-bis(2-methoxyphenyl)benzene-1,3-diamine
CID 19024304

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-(2-methoxyphenyl)aniline?
The IUPAC name of 2,4-difluoro-N-(2-methoxyphenyl)aniline (CID 82537085) is 2,4-difluoro-N-(2-methoxyphenyl)aniline.
What is the SMILES notation for 2,4-difluoro-N-(2-methoxyphenyl)aniline?
The canonical SMILES for 2,4-difluoro-N-(2-methoxyphenyl)aniline is COc1ccccc1Nc1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-N-(2-methoxyphenyl)aniline?
The InChIKey is NTYSQIPPOBBOGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2NO/c1-17-13-5-3-2-4-12(13)16-11-7-6-9(14)8-10(11)15/h2-8,16H,1H3.
What are the key properties of 2,4-difluoro-N-(2-methoxyphenyl)aniline?
2,4-difluoro-N-(2-methoxyphenyl)aniline 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 2,4-difluoro-N-(2-methoxyphenyl)aniline is sourced from PubChem (CID 82537085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).