N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide

C19H17NO5S — CID 162132868

IUPACN-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide
SMILESCOc1cc(C(=O)CNS(=O)(=O)c2ccccc2)cc(-c2ccco2)c1
InChIInChI=1S/C19H17NO5S/c1-24-16-11-14(10-15(12-16)19-8-5-9-25-19)18(21)13-20-26(22,23)17-6-3-2-4-7-17/h2-12,20H,13H2,1H3
InChIKeyZIWVZRDZYZSQCM-UHFFFAOYSA-N
MW371.41 g/mol
LogP3.12
Rot. Bonds7

About N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide

N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide (PubChem CID 162132868) has the molecular formula C19H17NO5S and a molecular weight of 371.41 g/mol. Its IUPAC name is N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide
PubChem CID162132868
Molecular FormulaC19H17NO5S
Molecular Weight371.41 g/mol
Exact Mass371.08
IUPAC NameN-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide
SMILESCOc1cc(C(=O)CNS(=O)(=O)c2ccccc2)cc(-c2ccco2)c1
InChIInChI=1S/C19H17NO5S/c1-24-16-11-14(10-15(12-16)19-8-5-9-25-19)18(21)13-20-26(22,23)17-6-3-2-4-7-17/h2-12,20H,13H2,1H3
InChIKeyZIWVZRDZYZSQCM-UHFFFAOYSA-N
XLogP3.12
TPSA85.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.41
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(3-methoxyphenyl)-2-oxoethyl]benzenesulfonamide
CID 94317245
N-[2-(benzenesulfonamido)ethyl]-3,5-dimethoxybenzamide
CID 108571361
2-(benzenesulfonamido)-N-[(4-methoxyphenyl)methyl]acetamide
CID 112992791
1-(3,5-dimethoxyphenyl)-3-phenylpropane-1,3-dione
CID 91159329
2-anilino-1-(3,5-dimethoxyphenyl)ethanone
CID 116555372
N'-(2-fluorophenyl)sulfanyl-3-(furan-2-yl)-5-methoxybenzohydrazide
CID 155393058
2-[(4-methoxyphenyl)sulfonylamino]-N-[(1S)-1-phenylethyl]acetamide
CID 40720374
N-[2-oxo-2-[4-(trifluoromethyl)phenyl]ethyl]benzenesulfonamide
CID 58597511
N-[(2R)-2-(furan-2-yl)-2-methoxyethyl]benzenesulfonamide
CID 99876447
[4-(furan-2-yl)-2,6-dimethoxyphenyl] benzoate
CID 58431996
2-(benzenesulfonamido)-N-[(Z)-1-(furan-2-yl)ethylideneamino]acetamide
CID 9236586
2-(benzenesulfonamido)-N-[(E)-(2-hydroxy-5-methoxyphenyl)methylideneamino]acetamide
CID 135710674

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide?
The IUPAC name of N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide (CID 162132868) is N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide.
What is the SMILES notation for N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide?
The canonical SMILES for N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide is COc1cc(C(=O)CNS(=O)(=O)c2ccccc2)cc(-c2ccco2)c1.
What is the InChIKey of N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide?
The InChIKey is ZIWVZRDZYZSQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO5S/c1-24-16-11-14(10-15(12-16)19-8-5-9-25-19)18(21)13-20-26(22,23)17-6-3-2-4-7-17/h2-12,20H,13H2,1H3.
What are the key properties of N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide?
N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide has a molecular weight of 371.41 g/mol, XLogP of 3.12, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-(furan-2-yl)-5-methoxyphenyl]-2-oxoethyl]benzenesulfonamide is sourced from PubChem (CID 162132868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).