4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide

C15H18N2O5S — CID 171140383

IUPAC4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide
SMILESCCOc1ccc(C(=O)NC)cc1S(=O)(=O)NCc1ccco1
InChIInChI=1S/C15H18N2O5S/c1-3-21-13-7-6-11(15(18)16-2)9-14(13)23(19,20)17-10-12-5-4-8-22-12/h4-9,17H,3,10H2,1-2H3,(H,16,18)
InChIKeyAZAMIZJHNXZZMZ-UHFFFAOYSA-N
MW338.39 g/mol
LogP1.52
Rot. Bonds7

About 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide

4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide (PubChem CID 171140383) has the molecular formula C15H18N2O5S and a molecular weight of 338.39 g/mol. Its IUPAC name is 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide.

Molecular Properties

Compound Name4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide
PubChem CID171140383
Molecular FormulaC15H18N2O5S
Molecular Weight338.39 g/mol
Exact Mass338.09
IUPAC Name4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide
SMILESCCOc1ccc(C(=O)NC)cc1S(=O)(=O)NCc1ccco1
InChIInChI=1S/C15H18N2O5S/c1-3-21-13-7-6-11(15(18)16-2)9-14(13)23(19,20)17-10-12-5-4-8-22-12/h4-9,17H,3,10H2,1-2H3,(H,16,18)
InChIKeyAZAMIZJHNXZZMZ-UHFFFAOYSA-N
XLogP1.52
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-acetyl-N-(furan-2-ylmethyl)-2-methoxybenzenesulfonamide
CID 39445497
5-ethoxy-N-(furan-2-ylmethyl)-2,4-dimethylbenzenesulfonamide
CID 934715
3-ethoxy-N-(furan-2-ylmethyl)-4-methoxybenzamide
CID 35808851
N-[1-(3,4-diethoxyphenyl)ethyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 55347369
3-ethoxy-4-fluoro-N-(furan-2-ylmethyl)benzenesulfonamide
CID 934514
3-(furan-2-ylmethylsulfamoyl)-4-(2-methoxyethylamino)benzoic acid
CID 99979694
4-chloro-N-(4-ethylphenyl)-3-(furan-2-ylmethylsulfamoyl)benzamide
CID 36705186
5-chloro-N-(furan-2-ylmethyl)-2-methoxybenzenesulfonamide
CID 686051
3-bromo-N-[4-(furan-2-ylmethylsulfamoyl)phenyl]-4-propoxybenzamide
CID 17170977
N-[(2-ethoxy-4-pyridinyl)methyl]-4-(furan-2-ylmethylsulfamoyl)benzamide
CID 55707674
4-fluoro-3-(furan-2-ylmethylsulfamoyl)-N-(3-methylphenyl)benzamide
CID 3435304
3-(furan-2-ylmethylsulfamoyl)-4-(propan-2-ylamino)benzoic acid
CID 99979635

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide?
The IUPAC name of 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide (CID 171140383) is 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide.
What is the SMILES notation for 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide?
The canonical SMILES for 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide is CCOc1ccc(C(=O)NC)cc1S(=O)(=O)NCc1ccco1.
What is the InChIKey of 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide?
The InChIKey is AZAMIZJHNXZZMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O5S/c1-3-21-13-7-6-11(15(18)16-2)9-14(13)23(19,20)17-10-12-5-4-8-22-12/h4-9,17H,3,10H2,1-2H3,(H,16,18).
What are the key properties of 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide?
4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide has a molecular weight of 338.39 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-3-(furan-2-ylmethylsulfamoyl)-N-methylbenzamide is sourced from PubChem (CID 171140383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).