2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide

C11H11F2N3O3S2 — CID 63944418

IUPAC2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(N)sc1S(=O)(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C11H11F2N3O3S2/c1-6-9(20-11(14)15-6)21(17,18)16-7-4-2-3-5-8(7)19-10(12)13/h2-5,10,16H,1H3,(H2,14,15)
InChIKeyJYHMTUHMVJCNSA-UHFFFAOYSA-N
MW335.36 g/mol
LogP2.44
Rot. Bonds5

About 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide

2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 63944418) has the molecular formula C11H11F2N3O3S2 and a molecular weight of 335.36 g/mol. Its IUPAC name is 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide
PubChem CID63944418
Molecular FormulaC11H11F2N3O3S2
Molecular Weight335.36 g/mol
Exact Mass335.02
IUPAC Name2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1nc(N)sc1S(=O)(=O)Nc1ccccc1OC(F)F
InChIInChI=1S/C11H11F2N3O3S2/c1-6-9(20-11(14)15-6)21(17,18)16-7-4-2-3-5-8(7)19-10(12)13/h2-5,10,16H,1H3,(H2,14,15)
InChIKeyJYHMTUHMVJCNSA-UHFFFAOYSA-N
XLogP2.44
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide (CID 63944418) is 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide is Cc1nc(N)sc1S(=O)(=O)Nc1ccccc1OC(F)F.
What is the InChIKey of 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is JYHMTUHMVJCNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F2N3O3S2/c1-6-9(20-11(14)15-6)21(17,18)16-7-4-2-3-5-8(7)19-10(12)13/h2-5,10,16H,1H3,(H2,14,15).
What are the key properties of 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide?
2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 335.36 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(difluoromethoxy)phenyl]-4-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 63944418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).