N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide

C12H16N2O4S — CID 46292588

IUPACN,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1cc(-c2ccno2)oc1C
InChIInChI=1S/C12H16N2O4S/c1-4-14(5-2)19(15,16)12-8-11(17-9(12)3)10-6-7-13-18-10/h6-8H,4-5H2,1-3H3
InChIKeyQANFRYNPJBJTRH-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.27
Rot. Bonds5

About N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide

N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide (PubChem CID 46292588) has the molecular formula C12H16N2O4S and a molecular weight of 284.34 g/mol. Its IUPAC name is N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide.

Molecular Properties

Compound NameN,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
PubChem CID46292588
Molecular FormulaC12H16N2O4S
Molecular Weight284.34 g/mol
Exact Mass284.08
IUPAC NameN,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
SMILESCCN(CC)S(=O)(=O)c1cc(-c2ccno2)oc1C
InChIInChI=1S/C12H16N2O4S/c1-4-14(5-2)19(15,16)12-8-11(17-9(12)3)10-6-7-13-18-10/h6-8H,4-5H2,1-3H3
InChIKeyQANFRYNPJBJTRH-UHFFFAOYSA-N
XLogP2.27
TPSA76.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-methyl-N-(3-methylphenyl)-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292528
N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292577
N-(4-chloro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292486
N-ethyl-2-methyl-N-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]-5-(1H-pyrazol-5-yl)furan-3-sulfonamide
CID 131911965
1-N,1-N,2-N,2-N-tetraethylbenzene-1,2-disulfonamide
CID 3900555
5-amino-N,N-diethyl-2-methylbenzenesulfonamide
CID 3643281
4-[ethyl(2-methylbutyl)sulfamoyl]-5-methylfuran-2-carboxylic acid
CID 79477863
N-(cyclobutylmethyl)-N-ethyl-5-(hydroxymethyl)-2-methylfuran-3-sulfonamide
CID 107402674
2-chloro-N,N-diethyl-5-fluorobenzenesulfonamide
CID 115610807
2-amino-N,N-diethylpyridine-3-sulfonamide
CID 62150875
5-bromo-N,N-diethyl-2-fluorobenzenesulfonamide
CID 110760985
2-amino-5-chloro-N,N-diethyl-4-methylbenzenesulfonamide
CID 57246919

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
The IUPAC name of N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide (CID 46292588) is N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide.
What is the SMILES notation for N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
The canonical SMILES for N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide is CCN(CC)S(=O)(=O)c1cc(-c2ccno2)oc1C.
What is the InChIKey of N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
The InChIKey is QANFRYNPJBJTRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O4S/c1-4-14(5-2)19(15,16)12-8-11(17-9(12)3)10-6-7-13-18-10/h6-8H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide has a molecular weight of 284.34 g/mol, XLogP of 2.27, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide is sourced from PubChem (CID 46292588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).