N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide

C11H16N2O4S — CID 71757647

IUPACN-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide
SMILESCOc1ccc(CCNC(C)=O)cc1S(N)(=O)=O
InChIInChI=1S/C11H16N2O4S/c1-8(14)13-6-5-9-3-4-10(17-2)11(7-9)18(12,15)16/h3-4,7H,5-6H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyFXJCDQDADWPWHN-UHFFFAOYSA-N
MW272.33 g/mol
LogP0.02
Rot. Bonds5

About N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide

N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide (PubChem CID 71757647) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide
PubChem CID71757647
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC NameN-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide
SMILESCOc1ccc(CCNC(C)=O)cc1S(N)(=O)=O
InChIInChI=1S/C11H16N2O4S/c1-8(14)13-6-5-9-3-4-10(17-2)11(7-9)18(12,15)16/h3-4,7H,5-6H2,1-2H3,(H,13,14)(H2,12,15,16)
InChIKeyFXJCDQDADWPWHN-UHFFFAOYSA-N
XLogP0.02
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide;trihydrate
CID 70552532
(E)-3-(2,4-dimethoxyphenyl)-N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]prop-2-enamide
CID 11304701
N-[(2R)-1-(4-methoxy-3-sulfamoylphenyl)propan-2-yl]acetamide
CID 14099978
N'-(2-acetamidoethyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]oxamide
CID 108506297
5-(4-aminobutyl)-2-methoxybenzenesulfonamide;hydrochloride
CID 22157092
2-(3-hydroxy-4-methoxyphenyl)ethylcarbamic acid
CID 174214574
2-(4-methoxy-3-sulfamoylphenyl)-N-pentan-3-ylacetamide
CID 65374268
N-[2-(3,4-dimethoxyphenyl)ethyl]-5-sulfamoylfuran-2-carboxamide
CID 84575585
5-chloro-N-[2-(4-ethynyl-3-sulfamoylphenyl)ethyl]-2-methoxybenzamide
CID 10500755
2-chloro-N-[2-(3-hydroxy-4-methoxyphenyl)ethyl]acetamide
CID 82110100
N-[2-(4-methoxy-3-methylphenyl)ethyl]-2-oxopropanamide
CID 115175869
N,N-diethyl-2-(4-methoxy-3-sulfamoylphenyl)acetamide
CID 65373612

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide?
The IUPAC name of N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide (CID 71757647) is N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide.
What is the SMILES notation for N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide?
The canonical SMILES for N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide is COc1ccc(CCNC(C)=O)cc1S(N)(=O)=O.
What is the InChIKey of N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide?
The InChIKey is FXJCDQDADWPWHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-8(14)13-6-5-9-3-4-10(17-2)11(7-9)18(12,15)16/h3-4,7H,5-6H2,1-2H3,(H,13,14)(H2,12,15,16).
What are the key properties of N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide?
N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide has a molecular weight of 272.33 g/mol, XLogP of 0.02, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxy-3-sulfamoylphenyl)ethyl]acetamide is sourced from PubChem (CID 71757647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).