5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide

C10H15BrN2O4S — CID 65388655

IUPAC5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide
SMILESCCC(C)CNC(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C10H15BrN2O4S/c1-3-6(2)5-13-10(14)7-4-8(9(11)17-7)18(12,15)16/h4,6H,3,5H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyDNDOOSKNTZWRLB-UHFFFAOYSA-N
MW339.21 g/mol
LogP1.47
Rot. Bonds5

About 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide

5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide (PubChem CID 65388655) has the molecular formula C10H15BrN2O4S and a molecular weight of 339.21 g/mol. Its IUPAC name is 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide
PubChem CID65388655
Molecular FormulaC10H15BrN2O4S
Molecular Weight339.21 g/mol
Exact Mass337.99
IUPAC Name5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide
SMILESCCC(C)CNC(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C10H15BrN2O4S/c1-3-6(2)5-13-10(14)7-4-8(9(11)17-7)18(12,15)16/h4,6H,3,5H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyDNDOOSKNTZWRLB-UHFFFAOYSA-N
XLogP1.47
TPSA102.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.21
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-N-(2-methylsulfinylpropyl)-4-sulfamoylfuran-2-carboxamide
CID 113484536
5-bromo-N-(2-methyl-2-methylsulfonylpropyl)-4-sulfamoylfuran-2-carboxamide
CID 79558158
5-bromo-4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]furan-2-carboxamide
CID 79359692
5-bromo-N-(3,3-dimethylbutan-2-yl)-4-sulfamoylfuran-2-carboxamide
CID 113458101
4-bromo-2-chloro-N-(2-methylbutyl)-5-sulfamoylbenzamide
CID 65388652
2-bromo-5-[(3-methoxy-2-methylpropyl)carbamoyl]furan-3-sulfonyl chloride
CID 65396615
5-bromo-N-(2-butoxyethyl)-4-sulfamoylfuran-2-carboxamide
CID 65388437
5-bromo-N-(1-cyclopropylethyl)-4-sulfamoylfuran-2-carboxamide
CID 65388940
2-propan-2-yloxyethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65382070
5-methyl-N-(2-methylbutyl)-4-sulfamoylthiophene-2-carboxamide
CID 112676814
2-bromo-5-(2-methylpentan-3-ylcarbamoyl)furan-3-sulfonyl chloride
CID 65371395
2-bromo-5-(2-cyclopropylpropylcarbamoyl)furan-3-sulfonyl chloride
CID 113476424

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide (CID 65388655) is 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide is CCC(C)CNC(=O)c1cc(S(N)(=O)=O)c(Br)o1.
What is the InChIKey of 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide?
The InChIKey is DNDOOSKNTZWRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O4S/c1-3-6(2)5-13-10(14)7-4-8(9(11)17-7)18(12,15)16/h4,6H,3,5H2,1-2H3,(H,13,14)(H2,12,15,16).
What are the key properties of 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide?
5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide has a molecular weight of 339.21 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide is sourced from PubChem (CID 65388655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).