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

C10H15BrN2O5S — CID 112754747

IUPAC5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
SMILESCOC(C)CN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C10H15BrN2O5S/c1-6(17-3)5-13(2)10(14)7-4-8(9(11)18-7)19(12,15)16/h4,6H,5H2,1-3H3,(H2,12,15,16)
InChIKeyOPWYBRDDSZJZHU-UHFFFAOYSA-N
MW355.21 g/mol
LogP0.80
Rot. Bonds5

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

5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide (PubChem CID 112754747) has the molecular formula C10H15BrN2O5S and a molecular weight of 355.21 g/mol. Its IUPAC name is 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
PubChem CID112754747
Molecular FormulaC10H15BrN2O5S
Molecular Weight355.21 g/mol
Exact Mass353.99
IUPAC Name5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
SMILESCOC(C)CN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1
InChIInChI=1S/C10H15BrN2O5S/c1-6(17-3)5-13(2)10(14)7-4-8(9(11)18-7)19(12,15)16/h4,6H,5H2,1-3H3,(H2,12,15,16)
InChIKeyOPWYBRDDSZJZHU-UHFFFAOYSA-N
XLogP0.80
TPSA102.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
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

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Related Compounds

5-bromo-N-(2-methoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
CID 65387444
5-bromo-N-(2-ethoxyethyl)-N-methyl-4-sulfamoylfuran-2-carboxamide
CID 81074713
2-methyl-3-[methyl-(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]propanoic acid
CID 119228618
2-methoxyethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65381468
2-propan-2-yloxyethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65382070
5-bromo-N-(2-methylbutyl)-4-sulfamoylfuran-2-carboxamide
CID 65388655
5-bromo-N,N-bis(cyclopropylmethyl)-4-sulfamoylfuran-2-carboxamide
CID 65381791
tert-butyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 65379816
5-bromo-N-(2-methylsulfinylpropyl)-4-sulfamoylfuran-2-carboxamide
CID 113484536
5-bromo-N-(3,3-dimethylbutan-2-yl)-4-sulfamoylfuran-2-carboxamide
CID 113458101
5-bromo-N-(2-methyl-2-methylsulfonylpropyl)-4-sulfamoylfuran-2-carboxamide
CID 79558158
2-(3-methoxypropoxy)ethyl 5-bromo-4-sulfamoylfuran-2-carboxylate
CID 103181676

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The IUPAC name of 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide (CID 112754747) is 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide is COC(C)CN(C)C(=O)c1cc(S(N)(=O)=O)c(Br)o1.
What is the InChIKey of 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
The InChIKey is OPWYBRDDSZJZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN2O5S/c1-6(17-3)5-13(2)10(14)7-4-8(9(11)18-7)19(12,15)16/h4,6H,5H2,1-3H3,(H2,12,15,16).
What are the key properties of 5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide?
5-bromo-N-(2-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide has a molecular weight of 355.21 g/mol, XLogP of 0.80, 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-methoxypropyl)-N-methyl-4-sulfamoylfuran-2-carboxamide is sourced from PubChem (CID 112754747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).