5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide

C15H16N2O4S2 — CID 110363635

IUPAC5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(N3CCOCC3=O)cc2)s1
InChIInChI=1S/C15H16N2O4S2/c1-11-2-7-15(22-11)23(19,20)16-12-3-5-13(6-4-12)17-8-9-21-10-14(17)18/h2-7,16H,8-10H2,1H3
InChIKeyWJLVYKYLKZWXLT-UHFFFAOYSA-N
MW352.44 g/mol
LogP2.22
Rot. Bonds4

About 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide

5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide (PubChem CID 110363635) has the molecular formula C15H16N2O4S2 and a molecular weight of 352.44 g/mol. Its IUPAC name is 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide
PubChem CID110363635
Molecular FormulaC15H16N2O4S2
Molecular Weight352.44 g/mol
Exact Mass352.06
IUPAC Name5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccc(N3CCOCC3=O)cc2)s1
InChIInChI=1S/C15H16N2O4S2/c1-11-2-7-15(22-11)23(19,20)16-12-3-5-13(6-4-12)17-8-9-21-10-14(17)18/h2-7,16H,8-10H2,1H3
InChIKeyWJLVYKYLKZWXLT-UHFFFAOYSA-N
XLogP2.22
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.44
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-4-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]benzenesulfonamide
CID 110363640
5-methyl-N-[4-(1-morpholin-4-ylethyl)phenyl]thiophene-2-sulfonamide
CID 136525099
N-[4-[[4-(3-oxomorpholin-4-yl)phenyl]sulfamoyl]phenyl]acetamide
CID 110363646
5-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]thiophene-2-sulfonamide
CID 38941309
2-oxo-N-[4-(3-oxomorpholin-4-yl)phenyl]-1,3-dihydrobenzimidazole-5-sulfonamide
CID 110420138
N-(4-ethoxyphenyl)-4-(3-oxomorpholin-4-yl)benzenesulfonamide
CID 110372508
5-methyl-N-[4-(4-propan-2-ylpiperazin-1-yl)phenyl]thiophene-2-sulfonamide
CID 112502723
N-[4-(3-oxomorpholin-4-yl)phenyl]butane-1-sulfonamide
CID 110363609
5-ethyl-N-(4-morpholin-4-ylphenyl)thiophene-2-sulfonamide
CID 112981153
4-[4-(propan-2-ylamino)phenyl]morpholin-3-one
CID 70327069
1-(3-methylphenyl)-N-[4-(3-oxomorpholin-4-yl)phenyl]methanesulfonamide
CID 110363643
5-methyl-N-[4-(4-methylanilino)phenyl]thiophene-2-sulfonamide
CID 112986064

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide (CID 110363635) is 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)Nc2ccc(N3CCOCC3=O)cc2)s1.
What is the InChIKey of 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide?
The InChIKey is WJLVYKYLKZWXLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O4S2/c1-11-2-7-15(22-11)23(19,20)16-12-3-5-13(6-4-12)17-8-9-21-10-14(17)18/h2-7,16H,8-10H2,1H3.
What are the key properties of 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide?
5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide has a molecular weight of 352.44 g/mol, XLogP of 2.22, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(3-oxomorpholin-4-yl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 110363635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).