5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide

C9H13BrN2O5S — CID 65387444

IUPAC5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
SMILESCOCCN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C9H13BrN2O5S/c1-12(3-4-16-2)9(13)6-5-7(8(10)17-6)18(11,14)15/h5H,3-4H2,1-2H3,(H2,11,14,15)
InChIKeyLZHPGAXSRNWACW-UHFFFAOYSA-N
MW341.18 g/mol
LogP0.41
Rot. Bonds5

About 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide

5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide (PubChem CID 65387444) has the molecular formula C9H13BrN2O5S and a molecular weight of 341.18 g/mol. Its IUPAC name is 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
PubChem CID65387444
Molecular FormulaC9H13BrN2O5S
Molecular Weight341.18 g/mol
Exact Mass339.97
IUPAC Name5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
SMILESCOCCN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C9H13BrN2O5S/c1-12(3-4-16-2)9(13)6-5-7(8(10)17-6)18(11,14)15/h5H,3-4H2,1-2H3,(H2,11,14,15)
InChIKeyLZHPGAXSRNWACW-UHFFFAOYSA-N
XLogP0.41
TPSA102.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.18
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
CID 81074713
5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
CID 112754747
2-methoxyethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65381468
2-(3-methoxypropoxy)ethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 103181676
5-bromo-N-(2-methoxyethyl)-N,2-dimethyl-3-sulfamoylbenzamide
CID 65387443
N-(2-methoxyethyl)-N,2,4-trimethyl-5-sulfamoylbenzamide
CID 47468920
5-bromo-N-(2-butoxyethyl)-4-sulfamoylfuran-2-carboxamide
CID 65388437
5-bromo-N-(2-methyl-2-methylsulfonylpropyl)-4-sulfamoylfuran-2-carboxamide
CID 79558158
5-bromo-N,N-bis(cyclopropylmethyl)-4-sulfamoylfuran-2-carboxamide
CID 65381791
5-[3-methoxypropyl(methyl)carbamoyl]-2-methylfuran-3-sulfonyl chloride
CID 65398763
tert-butyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65379816
5-bromo-4-sulfamoyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]furan-2-carboxamide
CID 79359692

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide (CID 65387444) is 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide is COCCN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1.
What is the InChIKey of 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The InChIKey is LZHPGAXSRNWACW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13BrN2O5S/c1-12(3-4-16-2)9(13)6-5-7(8(10)17-6)18(11,14)15/h5H,3-4H2,1-2H3,(H2,11,14,15).
What are the key properties of 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide has a molecular weight of 341.18 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide is sourced from PubChem (CID 65387444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).