N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide

C15H17N3O6S2 — CID 26951375

IUPACN-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1NC(C)=O
InChIInChI=1S/C15H17N3O6S2/c1-10(19)17-14-9-13(7-8-15(14)24-2)26(22,23)18-11-3-5-12(6-4-11)25(16,20)21/h3-9,18H,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyIGUVIVQJEPJWDC-UHFFFAOYSA-N
MW399.45 g/mol
LogP1.10
Rot. Bonds6

About N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide

N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide (PubChem CID 26951375) has the molecular formula C15H17N3O6S2 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide
PubChem CID26951375
Molecular FormulaC15H17N3O6S2
Molecular Weight399.45 g/mol
Exact Mass399.06
IUPAC NameN-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1NC(C)=O
InChIInChI=1S/C15H17N3O6S2/c1-10(19)17-14-9-13(7-8-15(14)24-2)26(22,23)18-11-3-5-12(6-4-11)25(16,20)21/h3-9,18H,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyIGUVIVQJEPJWDC-UHFFFAOYSA-N
XLogP1.10
TPSA144.66 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 51.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-[(3,4-difluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 7514306
N-[5-[[4-(cyanomethyl)phenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 37263710
N-[5-[(3-fluorophenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 6460904
N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide
CID 30286465
N-[2-methoxy-5-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 7343262
N-[2-methoxy-5-[[4-methyl-3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]acetamide
CID 24580787
N-(3-acetamido-4-methoxyphenyl)-4-(phenylsulfamoyl)benzamide
CID 24666755
N-[5-[[5-(dimethylsulfamoyl)-2-hydroxyphenyl]sulfamoyl]-2-methoxyphenyl]acetamide
CID 25331599
N-[5-[(3-bromo-4-methoxyphenyl)sulfonylamino]-2-fluorophenyl]acetamide
CID 24656740
N-[5-[(1-ethylpyrazol-4-yl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 31913130
2-[(3-acetamido-4-methoxyphenyl)sulfonylamino]-N-(4-methylphenyl)benzamide
CID 71903202
N-[2-methoxy-5-[(2-methylpropan-2-yl)oxysulfamoyl]phenyl]acetamide
CID 82725075

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide (CID 26951375) is N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide is COc1ccc(S(=O)(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1NC(C)=O.
What is the InChIKey of N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide?
The InChIKey is IGUVIVQJEPJWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O6S2/c1-10(19)17-14-9-13(7-8-15(14)24-2)26(22,23)18-11-3-5-12(6-4-11)25(16,20)21/h3-9,18H,1-2H3,(H,17,19)(H2,16,20,21).
What are the key properties of N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide?
N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide has a molecular weight of 399.45 g/mol, XLogP of 1.10, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 26951375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).