2-fluoro-N-(4-fluorophenyl)-5-methylaniline

C13H11F2N — CID 56637557

IUPAC2-fluoro-N-(4-fluorophenyl)-5-methylaniline
SMILESCc1ccc(F)c(Nc2ccc(F)cc2)c1
InChIInChI=1S/C13H11F2N/c1-9-2-7-12(15)13(8-9)16-11-5-3-10(14)4-6-11/h2-8,16H,1H3
InChIKeyPYDAAZWKYQNDEC-UHFFFAOYSA-N
MW219.23 g/mol
LogP4.02
Rot. Bonds2

About 2-fluoro-N-(4-fluorophenyl)-5-methylaniline

2-fluoro-N-(4-fluorophenyl)-5-methylaniline (PubChem CID 56637557) has the molecular formula C13H11F2N and a molecular weight of 219.23 g/mol. Its IUPAC name is 2-fluoro-N-(4-fluorophenyl)-5-methylaniline.

Molecular Properties

Compound Name2-fluoro-N-(4-fluorophenyl)-5-methylaniline
PubChem CID56637557
Molecular FormulaC13H11F2N
Molecular Weight219.23 g/mol
Exact Mass219.09
IUPAC Name2-fluoro-N-(4-fluorophenyl)-5-methylaniline
SMILESCc1ccc(F)c(Nc2ccc(F)cc2)c1
InChIInChI=1S/C13H11F2N/c1-9-2-7-12(15)13(8-9)16-11-5-3-10(14)4-6-11/h2-8,16H,1H3
InChIKeyPYDAAZWKYQNDEC-UHFFFAOYSA-N
XLogP4.02
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.23
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(difluoromethoxy)phenyl]-2-fluoro-5-methylaniline
CID 56636646
N-(4-chlorophenyl)-2,5-difluoroaniline
CID 82536926
2-(2,5-difluoroanilino)-4-methylbenzonitrile
CID 62303625
2-amino-5-(2-fluoro-5-methylanilino)benzamide
CID 61307828
4-N-(2-fluoro-5-methylphenyl)-2-methoxybenzene-1,4-diamine
CID 55233142
2-(4-fluoroanilino)-5-methylbenzoic acid
CID 55222818
2-chloro-N-(2-fluoro-5-methylphenyl)pyridin-4-amine
CID 102823905
2-fluoro-N-[1-(4-fluorophenyl)ethyl]-5-methylaniline
CID 43088434
4-fluoro-1-N-(2-fluoro-5-methylphenyl)-5-methylbenzene-1,2-diamine
CID 103589902
N-(2-fluoro-5-methylphenyl)-1H-imidazol-2-amine
CID 106561042
2,6-dichloro-N-(2-fluoro-5-methylphenyl)aniline
CID 56618086
5-N-(2-fluoro-5-methylphenyl)-3-N-propylpyridine-3,5-diamine
CID 104532100

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(4-fluorophenyl)-5-methylaniline?
The IUPAC name of 2-fluoro-N-(4-fluorophenyl)-5-methylaniline (CID 56637557) is 2-fluoro-N-(4-fluorophenyl)-5-methylaniline.
What is the SMILES notation for 2-fluoro-N-(4-fluorophenyl)-5-methylaniline?
The canonical SMILES for 2-fluoro-N-(4-fluorophenyl)-5-methylaniline is Cc1ccc(F)c(Nc2ccc(F)cc2)c1.
What is the InChIKey of 2-fluoro-N-(4-fluorophenyl)-5-methylaniline?
The InChIKey is PYDAAZWKYQNDEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F2N/c1-9-2-7-12(15)13(8-9)16-11-5-3-10(14)4-6-11/h2-8,16H,1H3.
What are the key properties of 2-fluoro-N-(4-fluorophenyl)-5-methylaniline?
2-fluoro-N-(4-fluorophenyl)-5-methylaniline has a molecular weight of 219.23 g/mol, XLogP of 4.02, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(4-fluorophenyl)-5-methylaniline is sourced from PubChem (CID 56637557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).