2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide

C14H20N2O5S — CID 110707287

IUPAC2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide
SMILESCOc1cc(C)c(C)cc1S(=O)(=O)NCCN1CCOC1=O
InChIInChI=1S/C14H20N2O5S/c1-10-8-12(20-3)13(9-11(10)2)22(18,19)15-4-5-16-6-7-21-14(16)17/h8-9,15H,4-7H2,1-3H3
InChIKeyBWLJTRDVANMGAB-UHFFFAOYSA-N
MW328.39 g/mol
LogP1.04
Rot. Bonds6

About 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide

2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide (PubChem CID 110707287) has the molecular formula C14H20N2O5S and a molecular weight of 328.39 g/mol. Its IUPAC name is 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide
PubChem CID110707287
Molecular FormulaC14H20N2O5S
Molecular Weight328.39 g/mol
Exact Mass328.11
IUPAC Name2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide
SMILESCOc1cc(C)c(C)cc1S(=O)(=O)NCCN1CCOC1=O
InChIInChI=1S/C14H20N2O5S/c1-10-8-12(20-3)13(9-11(10)2)22(18,19)15-4-5-16-6-7-21-14(16)17/h8-9,15H,4-7H2,1-3H3
InChIKeyBWLJTRDVANMGAB-UHFFFAOYSA-N
XLogP1.04
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dimethoxy-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzenesulfonamide
CID 110719319
2-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzenesulfonamide
CID 110719352
3-[2-(5-methoxy-2-methylanilino)ethyl]-1,3-oxazolidin-2-one
CID 21071128
2,5-dimethoxy-N-[2-(3-oxomorpholin-4-yl)ethyl]benzenesulfonamide
CID 110722666
2-methoxy-4,5-dimethyl-N-(2-pyrazol-1-ylethyl)benzenesulfonamide
CID 110716631
2-methoxy-N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-4,5-dimethylbenzenesulfonamide
CID 42267582
2-methoxy-4,5-dimethyl-N-[(1-methylpiperidin-4-yl)methyl]benzenesulfonamide
CID 16887463
3-[2-(dimethylsulfamoylamino)ethyl]-2-oxo-1,3-oxazolidine
CID 110707262
2-methoxy-4-methyl-N-(3-morpholin-4-ylpropyl)-5-propan-2-ylbenzenesulfonamide
CID 3132631
1-(4-methylphenyl)-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]methanesulfonamide
CID 110707299
4-methyl-N-[3-(2-oxo-1,3-oxazolidin-3-yl)propyl]benzenesulfonamide
CID 110719303
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 42389503

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide?
The IUPAC name of 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide (CID 110707287) is 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide.
What is the SMILES notation for 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide?
The canonical SMILES for 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide is COc1cc(C)c(C)cc1S(=O)(=O)NCCN1CCOC1=O.
What is the InChIKey of 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide?
The InChIKey is BWLJTRDVANMGAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5S/c1-10-8-12(20-3)13(9-11(10)2)22(18,19)15-4-5-16-6-7-21-14(16)17/h8-9,15H,4-7H2,1-3H3.
What are the key properties of 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide?
2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide has a molecular weight of 328.39 g/mol, XLogP of 1.04, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,5-dimethyl-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]benzenesulfonamide is sourced from PubChem (CID 110707287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).