3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide

C10H15N3O5S — CID 110710461

IUPAC3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)NCC1CN(C)C(=O)O1
InChIInChI=1S/C10H15N3O5S/c1-6-9(7(2)18-12-6)19(15,16)11-4-8-5-13(3)10(14)17-8/h8,11H,4-5H2,1-3H3
InChIKeyQMMXIPDJOAFBSY-UHFFFAOYSA-N
MW289.31 g/mol
LogP0.02
Rot. Bonds4

About 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide

3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide (PubChem CID 110710461) has the molecular formula C10H15N3O5S and a molecular weight of 289.31 g/mol. Its IUPAC name is 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide.

Molecular Properties

Compound Name3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide
PubChem CID110710461
Molecular FormulaC10H15N3O5S
Molecular Weight289.31 g/mol
Exact Mass289.07
IUPAC Name3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide
SMILESCc1noc(C)c1S(=O)(=O)NCC1CN(C)C(=O)O1
InChIInChI=1S/C10H15N3O5S/c1-6-9(7(2)18-12-6)19(15,16)11-4-8-5-13(3)10(14)17-8/h8,11H,4-5H2,1-3H3
InChIKeyQMMXIPDJOAFBSY-UHFFFAOYSA-N
XLogP0.02
TPSA101.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 50.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide?
The IUPAC name of 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide (CID 110710461) is 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide.
What is the SMILES notation for 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide?
The canonical SMILES for 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide is Cc1noc(C)c1S(=O)(=O)NCC1CN(C)C(=O)O1.
What is the InChIKey of 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide?
The InChIKey is QMMXIPDJOAFBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O5S/c1-6-9(7(2)18-12-6)19(15,16)11-4-8-5-13(3)10(14)17-8/h8,11H,4-5H2,1-3H3.
What are the key properties of 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide?
3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide has a molecular weight of 289.31 g/mol, XLogP of 0.02, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]-1,2-oxazole-4-sulfonamide is sourced from PubChem (CID 110710461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).