N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide

C15H17N3O6S2 — CID 30286465

IUPACN-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NS(=O)(=O)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C15H17N3O6S2/c1-10(19)17-11-6-7-15(24-2)14(8-11)18-26(22,23)13-5-3-4-12(9-13)25(16,20)21/h3-9,18H,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyRMQCKYUSJLQESZ-UHFFFAOYSA-N
MW399.45 g/mol
LogP1.10
Rot. Bonds6

About N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide

N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide (PubChem CID 30286465) has the molecular formula C15H17N3O6S2 and a molecular weight of 399.45 g/mol. Its IUPAC name is N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide
PubChem CID30286465
Molecular FormulaC15H17N3O6S2
Molecular Weight399.45 g/mol
Exact Mass399.06
IUPAC NameN-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NS(=O)(=O)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C15H17N3O6S2/c1-10(19)17-11-6-7-15(24-2)14(8-11)18-26(22,23)13-5-3-4-12(9-13)25(16,20)21/h3-9,18H,1-2H3,(H,17,19)(H2,16,20,21)
InChIKeyRMQCKYUSJLQESZ-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-[3-[(3-bromophenyl)sulfonylamino]-4-methoxyphenyl]acetamide
CID 7938360
N-[2-methoxy-5-[(4-sulfamoylphenyl)sulfamoyl]phenyl]acetamide
CID 26951375
N-[3-[(4-ethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide
CID 4149127
N-[4-methoxy-3-(propan-2-ylsulfonylamino)phenyl]acetamide
CID 62998731
N-[3-[(2-cyanophenyl)sulfonylamino]-4-methoxyphenyl]acetamide
CID 9330046
N-(4-methoxyphenyl)-2-[(3-sulfamoylphenyl)sulfonylamino]benzamide
CID 30286393
N-[4-[(2-methoxy-4,5-dimethylphenyl)sulfamoyl]phenyl]acetamide
CID 110776847
N-[2-methoxy-5-[(2-methoxy-5-methylphenyl)sulfamoyl]phenyl]acetamide
CID 7343262
N-[3-[(5-chloro-2-methoxyphenyl)sulfamoyl]-4-methoxyphenyl]acetamide
CID 26952518
N-[3-[(3,5-dichloro-2-hydroxyphenyl)sulfonylamino]-4-methoxyphenyl]acetamide
CID 25036035
N-[4-methoxy-3-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonylamino]phenyl]acetamide
CID 16615850
N-(3-chloro-4-methoxyphenyl)-3-[(5-chloro-2-methoxyphenyl)sulfamoyl]benzamide
CID 27256046

Frequently Asked Questions

What is the IUPAC name of N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide?
The IUPAC name of N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide (CID 30286465) is N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide?
The canonical SMILES for N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide is COc1ccc(NC(C)=O)cc1NS(=O)(=O)c1cccc(S(N)(=O)=O)c1.
What is the InChIKey of N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide?
The InChIKey is RMQCKYUSJLQESZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O6S2/c1-10(19)17-11-6-7-15(24-2)14(8-11)18-26(22,23)13-5-3-4-12(9-13)25(16,20)21/h3-9,18H,1-2H3,(H,17,19)(H2,16,20,21).
What are the key properties of N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide?
N-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]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-[4-methoxy-3-[(3-sulfamoylphenyl)sulfonylamino]phenyl]acetamide is sourced from PubChem (CID 30286465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).