N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide

C16H18N2O5S — CID 1010065

IUPACN-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C16H18N2O5S/c1-11(19)17-12-4-7-14(8-5-12)24(20,21)18-15-10-13(22-2)6-9-16(15)23-3/h4-10,18H,1-3H3,(H,17,19)
InChIKeyVVYBOPRFGIFZSH-UHFFFAOYSA-N
MW350.40 g/mol
LogP2.46
Rot. Bonds6

About N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide

N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide (PubChem CID 1010065) has the molecular formula C16H18N2O5S and a molecular weight of 350.40 g/mol. Its IUPAC name is N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide
PubChem CID1010065
Molecular FormulaC16H18N2O5S
Molecular Weight350.40 g/mol
Exact Mass350.09
IUPAC NameN-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1
InChIInChI=1S/C16H18N2O5S/c1-11(19)17-12-4-7-14(8-5-12)24(20,21)18-15-10-13(22-2)6-9-16(15)23-3/h4-10,18H,1-3H3,(H,17,19)
InChIKeyVVYBOPRFGIFZSH-UHFFFAOYSA-N
XLogP2.46
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-Amino-2,5-dimethoxy-N-phenylbenzenesulfonamide
CID 104143
N4-Acetyl-N1-(2-methoxyphenyl)sulfanilamide
CID 668310
Acetamide, N-(2,5-dimethoxyphenyl)-2-phenylthio-
CID 532046
N-[4-(aminosulfonyl)phenyl]-2-(4-ethoxyphenoxy)acetamide
CID 1193007
N-(2,5-dimethoxyphenyl)-4-phenylsulfanylbutanamide
CID 4826814
N-{4-[(2,4-dimethoxyphenyl)sulfamoyl]phenyl}acetamide
CID 1118248
3-(2-Methoxyphenyl)-1-(4-sulfamoylphenyl)urea
CID 307522
N-(2,5-dimethoxyphenyl)-4-ethoxybenzenesulfonamide
CID 894322
1-(3-Propan-2-yloxyphenyl)-3-(4-sulfamoylphenyl)urea
CID 122179484
Rac1-IN-5
CID 2198266
N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]prop-2-enamide
CID 137353879
N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]-3-(4-methylphenoxy)propanamide
CID 137353897

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide (CID 1010065) is N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide is COc1ccc(OC)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c1.
What is the InChIKey of N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is VVYBOPRFGIFZSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S/c1-11(19)17-12-4-7-14(8-5-12)24(20,21)18-15-10-13(22-2)6-9-16(15)23-3/h4-10,18H,1-3H3,(H,17,19).
What are the key properties of N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide?
N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 350.40 g/mol, XLogP of 2.46, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 1010065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).