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

C10H15BrN2O5S — CID 81074713

IUPAC5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
SMILESCCOCCN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C10H15BrN2O5S/c1-3-17-5-4-13(2)10(14)7-6-8(9(11)18-7)19(12,15)16/h6H,3-5H2,1-2H3,(H2,12,15,16)
InChIKeyGNTNJNRYYMYLEF-UHFFFAOYSA-N
MW355.21 g/mol
LogP0.80
Rot. Bonds6

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

5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide (PubChem CID 81074713) has the molecular formula C10H15BrN2O5S and a molecular weight of 355.21 g/mol. Its IUPAC name is 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
PubChem CID81074713
Molecular FormulaC10H15BrN2O5S
Molecular Weight355.21 g/mol
Exact Mass353.99
IUPAC Name5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
SMILESCCOCCN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C10H15BrN2O5S/c1-3-17-5-4-13(2)10(14)7-6-8(9(11)18-7)19(12,15)16/h6H,3-5H2,1-2H3,(H2,12,15,16)
InChIKeyGNTNJNRYYMYLEF-UHFFFAOYSA-N
XLogP0.80
TPSA102.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.21
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
CID 65387444
5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
CID 112754747
5-[2-ethoxyethyl(methyl)carbamoyl]-2-methylfuran-3-sulfonyl chloride
CID 81073813
3-bromo-N-(2-ethoxyethyl)-N-methyl-5-sulfamoylbenzamide
CID 81074001
5-bromo-N-(2-ethoxyethyl)-N-methylfuran-2-carboxamide
CID 81055957
3,4-dichloro-N-(2-ethoxyethyl)-N-methyl-5-sulfamoylbenzamide
CID 81063673
5-bromo-N-(2-butoxyethyl)-4-sulfamoylfuran-2-carboxamide
CID 65388437
2-methoxyethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65381468
3,5-dibromo-N-(2-ethoxyethyl)-N-methylbenzamide
CID 103909435
hexyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65382703
5-(aminomethyl)-N-(2-ethoxyethyl)-N-methylfuran-2-carboxamide
CID 81058548
5-bromo-N,N-bis(cyclopropylmethyl)-4-sulfamoylfuran-2-carboxamide
CID 65381791

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide (CID 81074713) is 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide is CCOCCN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1.
What is the InChIKey of 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The InChIKey is GNTNJNRYYMYLEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O5S/c1-3-17-5-4-13(2)10(14)7-6-8(9(11)18-7)19(12,15)16/h6H,3-5H2,1-2H3,(H2,12,15,16).
What are the key properties of 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide has a molecular weight of 355.21 g/mol, XLogP of 0.80, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide is sourced from PubChem (CID 81074713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).