5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide

C17H16FN3O4S — CID 53175653

IUPAC5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide
SMILESCc1ccc(F)cc1NS(=O)(=O)c1ccc(-c2nnc(C3CCC3)o2)o1
InChIInChI=1S/C17H16FN3O4S/c1-10-5-6-12(18)9-13(10)21-26(22,23)15-8-7-14(24-15)17-20-19-16(25-17)11-3-2-4-11/h5-9,11,21H,2-4H2,1H3
InChIKeyDQEVFOBWTXWKKH-UHFFFAOYSA-N
MW377.40 g/mol
LogP3.85
Rot. Bonds5

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

5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide (PubChem CID 53175653) has the molecular formula C17H16FN3O4S and a molecular weight of 377.40 g/mol. Its IUPAC name is 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide
PubChem CID53175653
Molecular FormulaC17H16FN3O4S
Molecular Weight377.40 g/mol
Exact Mass377.08
IUPAC Name5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide
SMILESCc1ccc(F)cc1NS(=O)(=O)c1ccc(-c2nnc(C3CCC3)o2)o1
InChIInChI=1S/C17H16FN3O4S/c1-10-5-6-12(18)9-13(10)21-26(22,23)15-8-7-14(24-15)17-20-19-16(25-17)11-3-2-4-11/h5-9,11,21H,2-4H2,1H3
InChIKeyDQEVFOBWTXWKKH-UHFFFAOYSA-N
XLogP3.85
TPSA98.23 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.40
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide with MolForge

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Related Compounds

5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-N-(2-fluoro-4-methylphenyl)furan-2-sulfonamide
CID 53175599
5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-N-(4-fluoro-3-methylphenyl)furan-2-sulfonamide
CID 53175598
5-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-(3,5-dimethoxyphenyl)furan-2-sulfonamide
CID 53175685
5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-cycloheptylfuran-2-sulfonamide
CID 53175630
5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-N-(3-methylphenyl)furan-2-sulfonamide
CID 53175564
N-cycloheptyl-5-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)furan-2-sulfonamide
CID 53175567
5-(5-cyclopentyl-1,3,4-oxadiazol-2-yl)-N-[(4-methylphenyl)methyl]furan-2-sulfonamide
CID 53175709
4-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-N-(2,5-dimethylphenyl)-1,2,5-trimethylpyrrole-3-sulfonamide
CID 53154926
3,4-dichloro-N-(5-fluoro-2-methylphenyl)benzenesulfonamide
CID 8501117
N-(2-chloro-4-methylphenyl)-5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)thiophene-2-sulfonamide
CID 53068247
2-cyclobutyl-5-[5-[(3S)-3-methylpiperidin-1-yl]sulfonylfuran-2-yl]-1,3,4-oxadiazole
CID 95103469
5-fluoro-N-(5-fluoro-2-methylphenyl)-2-methylbenzenesulfonamide
CID 47309539

Frequently Asked Questions

What is the IUPAC name of 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide?
The IUPAC name of 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide (CID 53175653) is 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide?
The canonical SMILES for 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide is Cc1ccc(F)cc1NS(=O)(=O)c1ccc(-c2nnc(C3CCC3)o2)o1.
What is the InChIKey of 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide?
The InChIKey is DQEVFOBWTXWKKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O4S/c1-10-5-6-12(18)9-13(10)21-26(22,23)15-8-7-14(24-15)17-20-19-16(25-17)11-3-2-4-11/h5-9,11,21H,2-4H2,1H3.
What are the key properties of 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide?
5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide has a molecular weight of 377.40 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)-N-(5-fluoro-2-methylphenyl)furan-2-sulfonamide is sourced from PubChem (CID 53175653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).