N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide

C7H12N2O3S — CID 43258971

IUPACN-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
SMILESCCNS(=O)(=O)Cc1cc(C)on1
InChIInChI=1S/C7H12N2O3S/c1-3-8-13(10,11)5-7-4-6(2)12-9-7/h4,8H,3,5H2,1-2H3
InChIKeyQPPVGUMEJOOZPX-UHFFFAOYSA-N
MW204.25 g/mol
LogP0.42
Rot. Bonds4

About N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide

N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide (PubChem CID 43258971) has the molecular formula C7H12N2O3S and a molecular weight of 204.25 g/mol. Its IUPAC name is N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide.

Molecular Properties

Compound NameN-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
PubChem CID43258971
Molecular FormulaC7H12N2O3S
Molecular Weight204.25 g/mol
Exact Mass204.06
IUPAC NameN-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
SMILESCCNS(=O)(=O)Cc1cc(C)on1
InChIInChI=1S/C7H12N2O3S/c1-3-8-13(10,11)5-7-4-6(2)12-9-7/h4,8H,3,5H2,1-2H3
InChIKeyQPPVGUMEJOOZPX-UHFFFAOYSA-N
XLogP0.42
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromoethyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 43133689
1-(5-methyl-1,2-oxazol-3-yl)-N-[2-(propylamino)ethyl]methanesulfonamide
CID 55101025
2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]acetic acid
CID 28787877
N-(2-hydroxypropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 43502409
methyl 2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]acetate
CID 43624220
N-(6-hydroxyhexyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 103918339
N-(3-amino-2,2-difluoropropyl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 114384148
N-(1-aminobutan-2-yl)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 65193475
1-(5-methyl-1,2-oxazol-3-yl)-N-[(5-methyl-1H-pyrazol-4-yl)methyl]methanesulfonamide
CID 54896768
N-[(2R)-1-hydroxypropan-2-yl]-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 64722552
N-(2-methoxyethoxy)-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide
CID 82714251
(2S)-2-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]propanoic acid
CID 28788047

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
The IUPAC name of N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide (CID 43258971) is N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide.
What is the SMILES notation for N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
The canonical SMILES for N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide is CCNS(=O)(=O)Cc1cc(C)on1.
What is the InChIKey of N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
The InChIKey is QPPVGUMEJOOZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O3S/c1-3-8-13(10,11)5-7-4-6(2)12-9-7/h4,8H,3,5H2,1-2H3.
What are the key properties of N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide?
N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide has a molecular weight of 204.25 g/mol, XLogP of 0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methyl-1,2-oxazol-3-yl)methanesulfonamide is sourced from PubChem (CID 43258971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).