2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide

C11H14N2O5S — CID 11323624

IUPAC2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide
SMILESCOc1ccc(C[C@H]2COC(=O)N2)cc1S(N)(=O)=O
InChIInChI=1S/C11H14N2O5S/c1-17-9-3-2-7(5-10(9)19(12,15)16)4-8-6-18-11(14)13-8/h2-3,5,8H,4,6H2,1H3,(H,13,14)(H2,12,15,16)/t8-/m0/s1
InChIKeyKUYMXFTZMRWBOG-QMMMGPOBSA-N
MW286.31 g/mol
LogP-0.01
Rot. Bonds4

About 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide

2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide (PubChem CID 11323624) has the molecular formula C11H14N2O5S and a molecular weight of 286.31 g/mol. Its IUPAC name is 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide
PubChem CID11323624
Molecular FormulaC11H14N2O5S
Molecular Weight286.31 g/mol
Exact Mass286.06
IUPAC Name2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide
SMILESCOc1ccc(C[C@H]2COC(=O)N2)cc1S(N)(=O)=O
InChIInChI=1S/C11H14N2O5S/c1-17-9-3-2-7(5-10(9)19(12,15)16)4-8-6-18-11(14)13-8/h2-3,5,8H,4,6H2,1H3,(H,13,14)(H2,12,15,16)/t8-/m0/s1
InChIKeyKUYMXFTZMRWBOG-QMMMGPOBSA-N
XLogP-0.01
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-5-(piperidin-4-ylmethyl)benzenesulfonamide;hydrochloride
CID 18539168
(4R)-4-[(4-methoxyphenyl)methyl]-1,3-oxazolidin-2-one
CID 10398104
(4S)-4-[(4-aminophenyl)methyl]-1,3-oxazolidin-2-one;ethane
CID 143785043
4-[(4-amino-3-iodophenyl)methyl]-1,3-oxazolidin-2-one
CID 19358405
4-[(4-iodophenyl)methyl]-1,3-oxazolidin-2-one
CID 175523266
4-[(4-propoxyphenyl)methyl]-1,3-oxazolidin-2-one
CID 18338957
5-(4-aminobutyl)-2-methoxybenzenesulfonamide;hydrochloride
CID 22157092
CID 149375552
CID 149375552
N-[(4-methoxy-3-sulfamoylphenyl)methyl]oxolane-2-carboxamide
CID 43246848
2-cyclobutyl-N-[(4-methoxy-3-sulfamoylphenyl)methyl]acetamide
CID 103164409
(4S)-4-[[3-[2-(dimethylamino)ethyl]-1H-indol-6-yl]methyl]-1,3-oxazolidin-2-one
CID 169444200
N,N-diethyl-2-(4-methoxy-3-sulfamoylphenyl)acetamide
CID 65373612

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide?
The IUPAC name of 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide (CID 11323624) is 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide.
What is the SMILES notation for 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide?
The canonical SMILES for 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide is COc1ccc(C[C@H]2COC(=O)N2)cc1S(N)(=O)=O.
What is the InChIKey of 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide?
The InChIKey is KUYMXFTZMRWBOG-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H14N2O5S/c1-17-9-3-2-7(5-10(9)19(12,15)16)4-8-6-18-11(14)13-8/h2-3,5,8H,4,6H2,1H3,(H,13,14)(H2,12,15,16)/t8-/m0/s1.
What are the key properties of 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide?
2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide has a molecular weight of 286.31 g/mol, XLogP of -0.01, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[[(4S)-2-oxo-1,3-oxazolidin-4-yl]methyl]benzenesulfonamide is sourced from PubChem (CID 11323624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).