2,6-difluoro-N-phenylaniline

C12H9F2N — CID 13387559

IUPAC2,6-difluoro-N-phenylaniline
SMILESFc1cccc(F)c1Nc1ccccc1
InChIInChI=1S/C12H9F2N/c13-10-7-4-8-11(14)12(10)15-9-5-2-1-3-6-9/h1-8,15H
InChIKeyCENFJISCCDXFSU-UHFFFAOYSA-N
MW205.21 g/mol
LogP3.71
Rot. Bonds2

About 2,6-difluoro-N-phenylaniline

2,6-difluoro-N-phenylaniline (PubChem CID 13387559) has the molecular formula C12H9F2N and a molecular weight of 205.21 g/mol. Its IUPAC name is 2,6-difluoro-N-phenylaniline.

Molecular Properties

Compound Name2,6-difluoro-N-phenylaniline
PubChem CID13387559
Molecular FormulaC12H9F2N
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name2,6-difluoro-N-phenylaniline
SMILESFc1cccc(F)c1Nc1ccccc1
InChIInChI=1S/C12H9F2N/c13-10-7-4-8-11(14)12(10)15-9-5-2-1-3-6-9/h1-8,15H
InChIKeyCENFJISCCDXFSU-UHFFFAOYSA-N
XLogP3.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-6-fluoro-N-phenylaniline
CID 18546408
3,6-difluoro-1-N,2-N,4-N,5-N-tetraphenylbenzene-1,2,4,5-tetramine
CID 101426182
2,6-difluoro-1-N-phenylbenzene-1,4-diamine
CID 61017044
N-(3-chlorophenyl)-2,6-difluoroaniline
CID 82536842
N-[4-(2,6-difluoroanilino)phenyl]-2-phenylacetamide
CID 112990214
2,6-difluoro-N-[3-(trifluoromethyl)phenyl]aniline
CID 82536810
2-bromo-3-fluoro-N-phenylaniline
CID 141346000
3-fluoro-N-phenylaniline
CID 2774466
azane;N-phenylaniline
CID 67074378
N-[4-(2,6-difluoroanilino)phenyl]-3-phenoxypropanamide
CID 112990218
3-fluoro-2-N-pyridin-4-ylbenzene-1,2-diamine
CID 115125636
4,5-dianilino-3,6-difluorophthalic acid
CID 139627144

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-phenylaniline?
The IUPAC name of 2,6-difluoro-N-phenylaniline (CID 13387559) is 2,6-difluoro-N-phenylaniline.
What is the SMILES notation for 2,6-difluoro-N-phenylaniline?
The canonical SMILES for 2,6-difluoro-N-phenylaniline is Fc1cccc(F)c1Nc1ccccc1.
What is the InChIKey of 2,6-difluoro-N-phenylaniline?
The InChIKey is CENFJISCCDXFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2N/c13-10-7-4-8-11(14)12(10)15-9-5-2-1-3-6-9/h1-8,15H.
What are the key properties of 2,6-difluoro-N-phenylaniline?
2,6-difluoro-N-phenylaniline has a molecular weight of 205.21 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-phenylaniline is sourced from PubChem (CID 13387559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).