2-amino-N-(3,5-difluorophenyl)ethanesulfonamide

C8H10F2N2O2S — CID 16792909

IUPAC2-amino-N-(3,5-difluorophenyl)ethanesulfonamide
SMILESNCCS(=O)(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C8H10F2N2O2S/c9-6-3-7(10)5-8(4-6)12-15(13,14)2-1-11/h3-5,12H,1-2,11H2
InChIKeyONKZCEOYCVCSOA-UHFFFAOYSA-N
MW236.24 g/mol
LogP0.67
Rot. Bonds4

About 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide

2-amino-N-(3,5-difluorophenyl)ethanesulfonamide (PubChem CID 16792909) has the molecular formula C8H10F2N2O2S and a molecular weight of 236.24 g/mol. Its IUPAC name is 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-(3,5-difluorophenyl)ethanesulfonamide
PubChem CID16792909
Molecular FormulaC8H10F2N2O2S
Molecular Weight236.24 g/mol
Exact Mass236.04
IUPAC Name2-amino-N-(3,5-difluorophenyl)ethanesulfonamide
SMILESNCCS(=O)(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C8H10F2N2O2S/c9-6-3-7(10)5-8(4-6)12-15(13,14)2-1-11/h3-5,12H,1-2,11H2
InChIKeyONKZCEOYCVCSOA-UHFFFAOYSA-N
XLogP0.67
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-difluorophenyl)-2-(propylamino)ethanesulfonamide
CID 114132499
2-amino-N-(4-fluoro-3-methoxyphenyl)ethanesulfonamide
CID 114839213
2-amino-N-(5-fluoro-2-methylphenyl)ethanesulfonamide
CID 16783174
2-amino-N-(3-bromo-5-methylphenyl)ethanesulfonamide
CID 107582977
2-amino-N-[3-bromo-5-(trifluoromethyl)phenyl]ethanesulfonamide
CID 65491007
2-amino-N-(4-chloro-2-fluorophenyl)ethanesulfonamide
CID 61472414
3-fluoro-5-(2-methoxyethylsulfonylamino)benzenesulfonamide
CID 55014078
N'-(3,5-difluorophenyl)ethane-1,2-diamine
CID 11116511
3-amino-N-(4-fluoro-3-methylphenyl)propane-1-sulfonamide
CID 62813181
2-amino-N-[2-fluoro-5-(trifluoromethyl)phenyl]ethanesulfonamide
CID 63037026
2-amino-N-(4-propylphenyl)ethanesulfonamide
CID 43378670
4-amino-N-(2-chloro-4,6-difluorophenyl)butane-1-sulfonamide
CID 114141795

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide?
The IUPAC name of 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide (CID 16792909) is 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide.
What is the SMILES notation for 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide?
The canonical SMILES for 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide is NCCS(=O)(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide?
The InChIKey is ONKZCEOYCVCSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O2S/c9-6-3-7(10)5-8(4-6)12-15(13,14)2-1-11/h3-5,12H,1-2,11H2.
What are the key properties of 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide?
2-amino-N-(3,5-difluorophenyl)ethanesulfonamide has a molecular weight of 236.24 g/mol, XLogP of 0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,5-difluorophenyl)ethanesulfonamide is sourced from PubChem (CID 16792909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).