2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide

C13H13F2NO4S — CID 99876460

IUPAC2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide
SMILESCO[C@H](CNS(=O)(=O)c1c(F)cccc1F)c1ccco1
InChIInChI=1S/C13H13F2NO4S/c1-19-12(11-6-3-7-20-11)8-16-21(17,18)13-9(14)4-2-5-10(13)15/h2-7,12,16H,8H2,1H3/t12-/m1/s1
InChIKeyDNXNASNSWUMCQL-GFCCVEGCSA-N
MW317.31 g/mol
LogP2.22
Rot. Bonds6

About 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide

2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide (PubChem CID 99876460) has the molecular formula C13H13F2NO4S and a molecular weight of 317.31 g/mol. Its IUPAC name is 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide.

Molecular Properties

Compound Name2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide
PubChem CID99876460
Molecular FormulaC13H13F2NO4S
Molecular Weight317.31 g/mol
Exact Mass317.05
IUPAC Name2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide
SMILESCO[C@H](CNS(=O)(=O)c1c(F)cccc1F)c1ccco1
InChIInChI=1S/C13H13F2NO4S/c1-19-12(11-6-3-7-20-11)8-16-21(17,18)13-9(14)4-2-5-10(13)15/h2-7,12,16H,8H2,1H3/t12-/m1/s1
InChIKeyDNXNASNSWUMCQL-GFCCVEGCSA-N
XLogP2.22
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.31
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide
CID 99876447
N-[2-(furan-2-yl)-2-methoxyethyl]-4-methoxybenzenesulfonamide
CID 121145607
2,6-difluoro-N-[2-(furan-2-yl)-2-methoxyethyl]benzamide
CID 121145483
N-[2-(furan-2-yl)-2-methoxyethyl]-4-propylbenzenesulfonamide
CID 121145620
N-[2-(furan-2-yl)-2-methoxyethyl]-2,4-dimethylbenzenesulfonamide
CID 121145601
N-[2-(furan-2-yl)-2-methoxyethyl]-4-methoxy-3-methylbenzenesulfonamide
CID 121145624
4-ethoxy-N-[2-(furan-2-yl)-2-methoxyethyl]-3,5-dimethylbenzenesulfonamide
CID 121145658
N-[4-[[2-(furan-2-yl)-2-methoxyethyl]sulfamoyl]-3-methylphenyl]acetamide
CID 121145655
methyl N-[2-(furan-2-yl)-2-methoxyethyl]carbamate
CID 121145445
2,6-difluoro-N-[3-(propan-2-ylamino)propyl]benzenesulfonamide
CID 43606877
2-fluoro-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]benzenesulfonamide
CID 90598088
2-fluoro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzenesulfonamide
CID 73168532

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide?
The IUPAC name of 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide (CID 99876460) is 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide.
What is the SMILES notation for 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide?
The canonical SMILES for 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide is CO[C@H](CNS(=O)(=O)c1c(F)cccc1F)c1ccco1.
What is the InChIKey of 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide?
The InChIKey is DNXNASNSWUMCQL-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H13F2NO4S/c1-19-12(11-6-3-7-20-11)8-16-21(17,18)13-9(14)4-2-5-10(13)15/h2-7,12,16H,8H2,1H3/t12-/m1/s1.
What are the key properties of 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide?
2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide has a molecular weight of 317.31 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide is sourced from PubChem (CID 99876460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).