N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide

C15H13FN2O4S — CID 46292577

IUPACN-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
SMILESCc1cc(F)ccc1NS(=O)(=O)c1cc(-c2ccno2)oc1C
InChIInChI=1S/C15H13FN2O4S/c1-9-7-11(16)3-4-12(9)18-23(19,20)15-8-14(21-10(15)2)13-5-6-17-22-13/h3-8,18H,1-2H3
InChIKeyPOVQWBWGKBVUHD-UHFFFAOYSA-N
MW336.34 g/mol
LogP3.49
Rot. Bonds4

About N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide

N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide (PubChem CID 46292577) has the molecular formula C15H13FN2O4S and a molecular weight of 336.34 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
PubChem CID46292577
Molecular FormulaC15H13FN2O4S
Molecular Weight336.34 g/mol
Exact Mass336.06
IUPAC NameN-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
SMILESCc1cc(F)ccc1NS(=O)(=O)c1cc(-c2ccno2)oc1C
InChIInChI=1S/C15H13FN2O4S/c1-9-7-11(16)3-4-12(9)18-23(19,20)15-8-14(21-10(15)2)13-5-6-17-22-13/h3-8,18H,1-2H3
InChIKeyPOVQWBWGKBVUHD-UHFFFAOYSA-N
XLogP3.49
TPSA85.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.34
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292486
N-(3-chlorophenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292481
2,4-difluoro-N-(4-fluoro-2-methylphenyl)benzenesulfonamide
CID 5020613
ethyl 4-[[2-methyl-5-(1,2-oxazol-5-yl)furan-3-yl]sulfonylamino]benzoate
CID 46292533
N-(4-fluoro-2-methylphenyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 22203197
2-amino-N-(4-fluoro-2-methylphenyl)pyridine-3-sulfonamide
CID 55044474
5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(4-fluoro-2-methylphenyl)furan-2-sulfonamide
CID 53085917
N-(furan-2-ylmethyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292504
2-methyl-5-(1,2-oxazol-5-yl)-N-(thiophen-2-ylmethyl)furan-3-sulfonamide
CID 46292566
2-amino-N-(4-fluoro-2-methylphenyl)-4,5-dimethylbenzenesulfonamide
CID 28556510
N,N-diethyl-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide
CID 46292588
5-(3,4-dimethyl-1,2-oxazol-5-yl)-N-(4-fluoro-2-methylphenyl)-2-methylbenzenesulfonamide
CID 20935537

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide (CID 46292577) is N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide is Cc1cc(F)ccc1NS(=O)(=O)c1cc(-c2ccno2)oc1C.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
The InChIKey is POVQWBWGKBVUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2O4S/c1-9-7-11(16)3-4-12(9)18-23(19,20)15-8-14(21-10(15)2)13-5-6-17-22-13/h3-8,18H,1-2H3.
What are the key properties of N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide?
N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide has a molecular weight of 336.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-2-methyl-5-(1,2-oxazol-5-yl)furan-3-sulfonamide is sourced from PubChem (CID 46292577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).