4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide

C11H10F2N2O3S2 — CID 61299189

IUPAC4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)Nc2ccc(OC(F)F)cc2)c1
InChIInChI=1S/C11H10F2N2O3S2/c12-11(13)18-9-3-1-8(2-4-9)15-20(16,17)10-5-7(14)6-19-10/h1-6,11,15H,14H2
InChIKeyQLKXVNKAVMVAIW-UHFFFAOYSA-N
MW320.34 g/mol
LogP2.73
Rot. Bonds5

About 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide

4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide (PubChem CID 61299189) has the molecular formula C11H10F2N2O3S2 and a molecular weight of 320.34 g/mol. Its IUPAC name is 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide
PubChem CID61299189
Molecular FormulaC11H10F2N2O3S2
Molecular Weight320.34 g/mol
Exact Mass320.01
IUPAC Name4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide
SMILESNc1csc(S(=O)(=O)Nc2ccc(OC(F)F)cc2)c1
InChIInChI=1S/C11H10F2N2O3S2/c12-11(13)18-9-3-1-8(2-4-9)15-20(16,17)10-5-7(14)6-19-10/h1-6,11,15H,14H2
InChIKeyQLKXVNKAVMVAIW-UHFFFAOYSA-N
XLogP2.73
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.34
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(4-chlorophenyl)thiophene-2-sulfonamide
CID 61301108
4-amino-N-(4-chloro-3-fluorophenyl)thiophene-2-sulfonamide
CID 54955525
5-cyano-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide
CID 106267245
4-amino-N-[4-(1,3-dioxolan-2-yl)phenyl]thiophene-2-sulfonamide
CID 106909778
4-amino-N-(3,4-dicyanophenyl)thiophene-2-sulfonamide
CID 107786924
methyl 5-[(4-aminothiophen-2-yl)sulfonylamino]-2-fluorobenzoate
CID 61300948
N-[4-(difluoromethoxy)phenyl]-3,4-difluorobenzenesulfonamide
CID 8504738
4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide
CID 46644155
4-amino-N-[3-(dimethylamino)-4-methylphenyl]thiophene-2-sulfonamide
CID 115375941
2,5-dibromo-N-[4-(difluoromethoxy)phenyl]benzenesulfonamide
CID 26980608
4-amino-N-(2,4,5-trifluorophenyl)thiophene-2-sulfonamide
CID 55118253
methyl N-[3-[(4-aminothiophen-2-yl)sulfonylamino]phenyl]carbamate
CID 61299815

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide (CID 61299189) is 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide is Nc1csc(S(=O)(=O)Nc2ccc(OC(F)F)cc2)c1.
What is the InChIKey of 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide?
The InChIKey is QLKXVNKAVMVAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2N2O3S2/c12-11(13)18-9-3-1-8(2-4-9)15-20(16,17)10-5-7(14)6-19-10/h1-6,11,15H,14H2.
What are the key properties of 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide?
4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide has a molecular weight of 320.34 g/mol, XLogP of 2.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(difluoromethoxy)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 61299189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).