4-(4-methoxybenzoyl)furan-2-sulfonamide

C12H11NO5S — CID 14639078

IUPAC4-(4-methoxybenzoyl)furan-2-sulfonamide
SMILESCOc1ccc(C(=O)c2coc(S(N)(=O)=O)c2)cc1
InChIInChI=1S/C12H11NO5S/c1-17-10-4-2-8(3-5-10)12(14)9-6-11(18-7-9)19(13,15)16/h2-7H,1H3,(H2,13,15,16)
InChIKeyOIEIIZQFSICKJF-UHFFFAOYSA-N
MW281.29 g/mol
LogP1.17
Rot. Bonds4

About 4-(4-methoxybenzoyl)furan-2-sulfonamide

4-(4-methoxybenzoyl)furan-2-sulfonamide (PubChem CID 14639078) has the molecular formula C12H11NO5S and a molecular weight of 281.29 g/mol. Its IUPAC name is 4-(4-methoxybenzoyl)furan-2-sulfonamide.

Molecular Properties

Compound Name4-(4-methoxybenzoyl)furan-2-sulfonamide
PubChem CID14639078
Molecular FormulaC12H11NO5S
Molecular Weight281.29 g/mol
Exact Mass281.04
IUPAC Name4-(4-methoxybenzoyl)furan-2-sulfonamide
SMILESCOc1ccc(C(=O)c2coc(S(N)(=O)=O)c2)cc1
InChIInChI=1S/C12H11NO5S/c1-17-10-4-2-8(3-5-10)12(14)9-6-11(18-7-9)19(13,15)16/h2-7H,1H3,(H2,13,15,16)
InChIKeyOIEIIZQFSICKJF-UHFFFAOYSA-N
XLogP1.17
TPSA99.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.29
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxybenzoyl)furan-2-sulfonamide?
The IUPAC name of 4-(4-methoxybenzoyl)furan-2-sulfonamide (CID 14639078) is 4-(4-methoxybenzoyl)furan-2-sulfonamide.
What is the SMILES notation for 4-(4-methoxybenzoyl)furan-2-sulfonamide?
The canonical SMILES for 4-(4-methoxybenzoyl)furan-2-sulfonamide is COc1ccc(C(=O)c2coc(S(N)(=O)=O)c2)cc1.
What is the InChIKey of 4-(4-methoxybenzoyl)furan-2-sulfonamide?
The InChIKey is OIEIIZQFSICKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO5S/c1-17-10-4-2-8(3-5-10)12(14)9-6-11(18-7-9)19(13,15)16/h2-7H,1H3,(H2,13,15,16).
What are the key properties of 4-(4-methoxybenzoyl)furan-2-sulfonamide?
4-(4-methoxybenzoyl)furan-2-sulfonamide has a molecular weight of 281.29 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxybenzoyl)furan-2-sulfonamide is sourced from PubChem (CID 14639078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).