4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide

C19H17FN2O4S — CID 30784702

IUPAC4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide
SMILESCNC(=O)c1ccc(S(=O)(=O)NCc2ccc(-c3ccc(F)cc3)o2)cc1
InChIInChI=1S/C19H17FN2O4S/c1-21-19(23)14-4-9-17(10-5-14)27(24,25)22-12-16-8-11-18(26-16)13-2-6-15(20)7-3-13/h2-11,22H,12H2,1H3,(H,21,23)
InChIKeyGHVLHZLXRVUOMB-UHFFFAOYSA-N
MW388.42 g/mol
LogP2.92
Rot. Bonds6

About 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide

4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide (PubChem CID 30784702) has the molecular formula C19H17FN2O4S and a molecular weight of 388.42 g/mol. Its IUPAC name is 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide
PubChem CID30784702
Molecular FormulaC19H17FN2O4S
Molecular Weight388.42 g/mol
Exact Mass388.09
IUPAC Name4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide
SMILESCNC(=O)c1ccc(S(=O)(=O)NCc2ccc(-c3ccc(F)cc3)o2)cc1
InChIInChI=1S/C19H17FN2O4S/c1-21-19(23)14-4-9-17(10-5-14)27(24,25)22-12-16-8-11-18(26-16)13-2-6-15(20)7-3-13/h2-11,22H,12H2,1H3,(H,21,23)
InChIKeyGHVLHZLXRVUOMB-UHFFFAOYSA-N
XLogP2.92
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.42
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-3-(methylsulfamoyl)benzamide
CID 36897387
4-fluoro-N-[(5-methylfuran-2-yl)methyl]benzenesulfonamide
CID 55081647
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-fluorobenzamide
CID 54858020
N-[(5-chlorofuran-2-yl)methyl]-4-fluorobenzenesulfonamide
CID 110732035
N-methyl-4-[(3-methyl-1,2-oxazol-5-yl)methylsulfamoyl]benzamide
CID 48944724
5-(4-fluorophenyl)-N-methyl-N-[[4-(methylcarbamoyl)phenyl]methyl]furan-2-carboxamide
CID 8967449
4-[(3,3-difluoro-2-hydroxypropyl)sulfamoyl]-N-methylbenzamide
CID 103836774
methyl (2S)-2-[[5-(4-fluorophenyl)furan-2-yl]methylamino]propanoate
CID 43723505
N-[[5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]furan-2-yl]methyl]methanesulfonamide
CID 71973851
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-3,4-dimethoxybenzamide
CID 24672781
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-3-(methanesulfonamido)benzamide
CID 36897993
4-[5-[[(4-fluorophenyl)methylamino]methyl]furan-2-yl]benzoic acid;hydrochloride
CID 17056095

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide?
The IUPAC name of 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide (CID 30784702) is 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide.
What is the SMILES notation for 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide?
The canonical SMILES for 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide is CNC(=O)c1ccc(S(=O)(=O)NCc2ccc(-c3ccc(F)cc3)o2)cc1.
What is the InChIKey of 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide?
The InChIKey is GHVLHZLXRVUOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN2O4S/c1-21-19(23)14-4-9-17(10-5-14)27(24,25)22-12-16-8-11-18(26-16)13-2-6-15(20)7-3-13/h2-11,22H,12H2,1H3,(H,21,23).
What are the key properties of 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide?
4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide has a molecular weight of 388.42 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(4-fluorophenyl)furan-2-yl]methylsulfamoyl]-N-methylbenzamide is sourced from PubChem (CID 30784702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).