4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide

C11H8FN3O2S2 — CID 61299391

IUPAC4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide
SMILESN#Cc1c(F)cccc1NS(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C11H8FN3O2S2/c12-9-2-1-3-10(8(9)5-13)15-19(16,17)11-4-7(14)6-18-11/h1-4,6,15H,14H2
InChIKeyIBYUWSHLSGPPOA-UHFFFAOYSA-N
MW297.34 g/mol
LogP2.14
Rot. Bonds3

About 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide

4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide (PubChem CID 61299391) has the molecular formula C11H8FN3O2S2 and a molecular weight of 297.34 g/mol. Its IUPAC name is 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide
PubChem CID61299391
Molecular FormulaC11H8FN3O2S2
Molecular Weight297.34 g/mol
Exact Mass297.00
IUPAC Name4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide
SMILESN#Cc1c(F)cccc1NS(=O)(=O)c1cc(N)cs1
InChIInChI=1S/C11H8FN3O2S2/c12-9-2-1-3-10(8(9)5-13)15-19(16,17)11-4-7(14)6-18-11/h1-4,6,15H,14H2
InChIKeyIBYUWSHLSGPPOA-UHFFFAOYSA-N
XLogP2.14
TPSA95.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(2,4,5-trifluorophenyl)thiophene-2-sulfonamide
CID 55118253
4-amino-N-(2-cyano-3-fluorophenyl)-3-fluorobenzenesulfonamide
CID 82845262
5-amino-N-(2-cyano-3-fluorophenyl)-2-methylbenzenesulfonamide
CID 43580304
5-bromo-N-(2-cyano-3-fluorophenyl)-4-methylthiophene-2-sulfonamide
CID 79989335
N-(2-cyano-3-fluorophenyl)-3-methylbenzenesulfonamide
CID 43580569
3-amino-4-bromo-N-(2-cyano-3-fluorophenyl)benzenesulfonamide
CID 115328819
4-amino-N-(2-fluoro-5-methylphenyl)thiophene-2-sulfonamide
CID 61300923
3-bromo-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide
CID 61458187
4-(aminomethyl)-N-(2,3-difluorophenyl)thiophene-2-sulfonamide
CID 106017490
2-[(4-aminothiophen-2-yl)sulfonylamino]benzamide
CID 61301321
4-amino-N-(3,4-dicyanophenyl)thiophene-2-sulfonamide
CID 107786924
4-amino-N-(2,5-dichlorophenyl)thiophene-2-sulfonamide
CID 61299181

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide (CID 61299391) is 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide is N#Cc1c(F)cccc1NS(=O)(=O)c1cc(N)cs1.
What is the InChIKey of 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide?
The InChIKey is IBYUWSHLSGPPOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8FN3O2S2/c12-9-2-1-3-10(8(9)5-13)15-19(16,17)11-4-7(14)6-18-11/h1-4,6,15H,14H2.
What are the key properties of 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide?
4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide has a molecular weight of 297.34 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-cyano-3-fluorophenyl)thiophene-2-sulfonamide is sourced from PubChem (CID 61299391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).