N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide

C17H15NO4S — CID 122184585

IUPACN-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2ccco2)cc1
InChIInChI=1S/C17H15NO4S/c1-21-13-8-10-14(11-9-13)23(19,20)18-16-6-3-2-5-15(16)17-7-4-12-22-17/h2-12,18H,1H3
InChIKeyJWKWRINNYATJPT-UHFFFAOYSA-N
MW329.38 g/mol
LogP3.76
Rot. Bonds5

About N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide

N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide (PubChem CID 122184585) has the molecular formula C17H15NO4S and a molecular weight of 329.38 g/mol. Its IUPAC name is N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide
PubChem CID122184585
Molecular FormulaC17H15NO4S
Molecular Weight329.38 g/mol
Exact Mass329.07
IUPAC NameN-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccccc2-c2ccco2)cc1
InChIInChI=1S/C17H15NO4S/c1-21-13-8-10-14(11-9-13)23(19,20)18-16-6-3-2-5-15(16)17-7-4-12-22-17/h2-12,18H,1H3
InChIKeyJWKWRINNYATJPT-UHFFFAOYSA-N
XLogP3.76
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide?
The IUPAC name of N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide (CID 122184585) is N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide.
What is the SMILES notation for N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide?
The canonical SMILES for N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide is COc1ccc(S(=O)(=O)Nc2ccccc2-c2ccco2)cc1.
What is the InChIKey of N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide?
The InChIKey is JWKWRINNYATJPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO4S/c1-21-13-8-10-14(11-9-13)23(19,20)18-16-6-3-2-5-15(16)17-7-4-12-22-17/h2-12,18H,1H3.
What are the key properties of N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide?
N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide has a molecular weight of 329.38 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)phenyl]-4-methoxybenzenesulfonamide is sourced from PubChem (CID 122184585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).