N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide

C11H10FNO3S2 — CID 64786506

IUPACN-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)s1
InChIInChI=1S/C11H10FNO3S2/c1-7-2-5-11(17-7)18(15,16)13-10-4-3-8(14)6-9(10)12/h2-6,13-14H,1H3
InChIKeyLSYIQOQRZBJHBB-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.70
Rot. Bonds3

About N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide

N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide (PubChem CID 64786506) has the molecular formula C11H10FNO3S2 and a molecular weight of 287.34 g/mol. Its IUPAC name is N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide
PubChem CID64786506
Molecular FormulaC11H10FNO3S2
Molecular Weight287.34 g/mol
Exact Mass287.01
IUPAC NameN-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)s1
InChIInChI=1S/C11H10FNO3S2/c1-7-2-5-11(17-7)18(15,16)13-10-4-3-8(14)6-9(10)12/h2-6,13-14H,1H3
InChIKeyLSYIQOQRZBJHBB-UHFFFAOYSA-N
XLogP2.70
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'sulfonamide_B(41)', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

5-chloro-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
CID 64786901
5-cyano-N-(2-fluoro-4-hydroxyphenyl)thiophene-2-sulfonamide
CID 106272305
N-(4-bromo-2,5-difluorophenyl)-5-methylthiophene-2-sulfonamide
CID 103844041
N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide
CID 64786305
N-[4-chloro-2-[(5-methylthiophen-2-yl)sulfonylamino]phenyl]acetamide
CID 86870275
5-bromo-N-(2-fluoro-4-methylphenyl)thiophene-2-sulfonamide
CID 8523278
N-(4-amino-2-methylphenyl)-5-methylthiophene-2-sulfonamide
CID 28783297
N-(3-chloro-4-fluorophenyl)-5-methylthiophene-2-sulfonamide
CID 18191076
N-(2-aminophenyl)-5-methylthiophene-2-sulfonamide
CID 28783373
N-(4-bromo-2-cyanophenyl)-5-methylthiophene-2-sulfonamide
CID 82708384
N-(2-chloro-4-methoxyphenyl)-5-methylthiophene-2-sulfonamide
CID 110777954
N-(2-fluoro-4-hydroxyphenyl)-2-methylpropane-1-sulfonamide
CID 64786303

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide?
The IUPAC name of N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide (CID 64786506) is N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide.
What is the SMILES notation for N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide?
The canonical SMILES for N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)s1.
What is the InChIKey of N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide?
The InChIKey is LSYIQOQRZBJHBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO3S2/c1-7-2-5-11(17-7)18(15,16)13-10-4-3-8(14)6-9(10)12/h2-6,13-14H,1H3.
What are the key properties of N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide?
N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide has a molecular weight of 287.34 g/mol, XLogP of 2.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-hydroxyphenyl)-5-methylthiophene-2-sulfonamide is sourced from PubChem (CID 64786506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).