N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide

C15H19NO6S — CID 174753590

IUPACN-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide
SMILESCCS(=O)(=O)N(C)C1=C(O)C(=O)C(C)(c2ccccc2OC)O1
InChIInChI=1S/C15H19NO6S/c1-5-23(19,20)16(3)14-12(17)13(18)15(2,22-14)10-8-6-7-9-11(10)21-4/h6-9,17H,5H2,1-4H3
InChIKeyLPXNJLSASKLJRR-UHFFFAOYSA-N
MW341.39 g/mol
LogP1.52
Rot. Bonds5

About N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide

N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide (PubChem CID 174753590) has the molecular formula C15H19NO6S and a molecular weight of 341.39 g/mol. Its IUPAC name is N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide.

Molecular Properties

Compound NameN-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide
PubChem CID174753590
Molecular FormulaC15H19NO6S
Molecular Weight341.39 g/mol
Exact Mass341.09
IUPAC NameN-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide
SMILESCCS(=O)(=O)N(C)C1=C(O)C(=O)C(C)(c2ccccc2OC)O1
InChIInChI=1S/C15H19NO6S/c1-5-23(19,20)16(3)14-12(17)13(18)15(2,22-14)10-8-6-7-9-11(10)21-4/h6-9,17H,5H2,1-4H3
InChIKeyLPXNJLSASKLJRR-UHFFFAOYSA-N
XLogP1.52
TPSA93.14 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.39
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-(2,3-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]-5-methyl-4-oxofuran-3-yl] acetate
CID 174753565
N-[5-(4-chloro-2-fluorophenyl)-3-hydroxy-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide
CID 175463080
N-(3-hydroxy-5-methyl-4-oxo-5-quinolin-3-ylfuran-2-yl)-N-methylethanesulfonamide
CID 174753543
[2-(methanesulfonamido)-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-3-yl] acetate
CID 140834161
[2-(benzenesulfonamido)-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-3-yl] acetate
CID 140834171
[5-(2,6-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]-4-hydroxyfuran-3-yl] acetate
CID 90080826
2-ethyl-1-(2-methoxyphenyl)cyclopropan-1-amine
CID 79332118
2-(2-methoxyphenyl)-2-propyl-1,3-dioxolane
CID 83957658
(3R)-3-hydroxy-3-(2-methoxyphenyl)-1H-indol-2-one
CID 7333204
ethyl (2R,3S)-2-(2-methoxyphenyl)-2-methyl-5-oxooxolane-3-carboxylate
CID 101240165
1a-ethyl-4-methoxy-7a-(2-methoxyphenyl)oxireno[2,3-b]chromen-7-one
CID 10616101
N-[1-(2-methoxyphenyl)cyclopropyl]butane-1-sulfonamide
CID 110440611

Frequently Asked Questions

What is the IUPAC name of N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide?
The IUPAC name of N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide (CID 174753590) is N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide.
What is the SMILES notation for N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide?
The canonical SMILES for N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide is CCS(=O)(=O)N(C)C1=C(O)C(=O)C(C)(c2ccccc2OC)O1.
What is the InChIKey of N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide?
The InChIKey is LPXNJLSASKLJRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO6S/c1-5-23(19,20)16(3)14-12(17)13(18)15(2,22-14)10-8-6-7-9-11(10)21-4/h6-9,17H,5H2,1-4H3.
What are the key properties of N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide?
N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide has a molecular weight of 341.39 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-hydroxy-5-(2-methoxyphenyl)-5-methyl-4-oxofuran-2-yl]-N-methylethanesulfonamide is sourced from PubChem (CID 174753590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).