N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide

C15H13N3O5S — CID 646589

IUPACN-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide
SMILESCc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)no1
InChIInChI=1S/C15H13N3O5S/c1-10-9-14(17-23-10)18-24(20,21)12-6-4-11(5-7-12)16-15(19)13-3-2-8-22-13/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyXVMXTZAWBRTNAG-UHFFFAOYSA-N
MW347.35 g/mol
LogP2.63
Rot. Bonds5

About N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide

N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide (PubChem CID 646589) has the molecular formula C15H13N3O5S and a molecular weight of 347.35 g/mol. Its IUPAC name is N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide
PubChem CID646589
Molecular FormulaC15H13N3O5S
Molecular Weight347.35 g/mol
Exact Mass347.06
IUPAC NameN-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide
SMILESCc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)no1
InChIInChI=1S/C15H13N3O5S/c1-10-9-14(17-23-10)18-24(20,21)12-6-4-11(5-7-12)16-15(19)13-3-2-8-22-13/h2-9H,1H3,(H,16,19)(H,17,18)
InChIKeyXVMXTZAWBRTNAG-UHFFFAOYSA-N
XLogP2.63
TPSA114.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.35
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide (CID 646589) is N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide is Cc1cc(NS(=O)(=O)c2ccc(NC(=O)c3ccco3)cc2)no1.
What is the InChIKey of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide?
The InChIKey is XVMXTZAWBRTNAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O5S/c1-10-9-14(17-23-10)18-24(20,21)12-6-4-11(5-7-12)16-15(19)13-3-2-8-22-13/h2-9H,1H3,(H,16,19)(H,17,18).
What are the key properties of N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide?
N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide has a molecular weight of 347.35 g/mol, XLogP of 2.63, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]furan-2-carboxamide is sourced from PubChem (CID 646589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).