N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide

C11H13F2NO3S — CID 43577670

IUPACN-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
SMILESO=S(=O)(c1c(F)cccc1F)N(CCO)C1CC1
InChIInChI=1S/C11H13F2NO3S/c12-9-2-1-3-10(13)11(9)18(16,17)14(6-7-15)8-4-5-8/h1-3,8,15H,4-7H2
InChIKeyRHEWJKZUFUTZTC-UHFFFAOYSA-N
MW277.29 g/mol
LogP1.11
Rot. Bonds5

About N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide

N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide (PubChem CID 43577670) has the molecular formula C11H13F2NO3S and a molecular weight of 277.29 g/mol. Its IUPAC name is N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
PubChem CID43577670
Molecular FormulaC11H13F2NO3S
Molecular Weight277.29 g/mol
Exact Mass277.06
IUPAC NameN-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
SMILESO=S(=O)(c1c(F)cccc1F)N(CCO)C1CC1
InChIInChI=1S/C11H13F2NO3S/c12-9-2-1-3-10(13)11(9)18(16,17)14(6-7-15)8-4-5-8/h1-3,8,15H,4-7H2
InChIKeyRHEWJKZUFUTZTC-UHFFFAOYSA-N
XLogP1.11
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.29
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-cyclobutyl-6-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 102859154
N-cyclopropyl-2-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577535
2-(aminomethyl)-N-cyclobutyl-3-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 102861412
4-amino-N-cyclobutyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 102859183
N-cyclopropyl-2,5-difluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577623
N-[(2-chloro-6-fluorophenyl)methyl]-N-cyclopropyl-2,6-difluorobenzenesulfonamide
CID 38254380
2,3-dichloro-N-cyclopropyl-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577659
N-cyclopropyl-N-(2-hydroxyethyl)-4-(propylamino)benzenesulfonamide
CID 62151572
N-cyclopropyl-2-fluoro-N-(2-hydroxyethyl)-5-methylbenzenesulfonamide
CID 43577516
N-cyclobutyl-4-fluoro-N-(2-hydroxyethyl)-2,6-dimethylbenzenesulfonamide
CID 107327564
N-cyclopropyl-2,6-difluoro-N-(pyrrolidin-2-ylmethyl)benzenesulfonamide
CID 106599513
2-chloro-6-fluoro-N-piperidin-4-yl-N-propylbenzenesulfonamide
CID 120712673

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide (CID 43577670) is N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide is O=S(=O)(c1c(F)cccc1F)N(CCO)C1CC1.
What is the InChIKey of N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide?
The InChIKey is RHEWJKZUFUTZTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2NO3S/c12-9-2-1-3-10(13)11(9)18(16,17)14(6-7-15)8-4-5-8/h1-3,8,15H,4-7H2.
What are the key properties of N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide?
N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide has a molecular weight of 277.29 g/mol, XLogP of 1.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2,6-difluoro-N-(2-hydroxyethyl)benzenesulfonamide is sourced from PubChem (CID 43577670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).