N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide

C17H15N3O4S — CID 4789220

IUPACN-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc3ccccc3n2)cc1S(N)(=O)=O
InChIInChI=1S/C17H15N3O4S/c1-24-15-9-7-12(10-16(15)25(18,22)23)19-17(21)14-8-6-11-4-2-3-5-13(11)20-14/h2-10H,1H3,(H,19,21)(H2,18,22,23)
InChIKeyDTEMUADBXUTSTK-UHFFFAOYSA-N
MW357.39 g/mol
LogP2.14
Rot. Bonds4

About N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide

N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide (PubChem CID 4789220) has the molecular formula C17H15N3O4S and a molecular weight of 357.39 g/mol. Its IUPAC name is N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide
PubChem CID4789220
Molecular FormulaC17H15N3O4S
Molecular Weight357.39 g/mol
Exact Mass357.08
IUPAC NameN-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide
SMILESCOc1ccc(NC(=O)c2ccc3ccccc3n2)cc1S(N)(=O)=O
InChIInChI=1S/C17H15N3O4S/c1-24-15-9-7-12(10-16(15)25(18,22)23)19-17(21)14-8-6-11-4-2-3-5-13(11)20-14/h2-10H,1H3,(H,19,21)(H2,18,22,23)
InChIKeyDTEMUADBXUTSTK-UHFFFAOYSA-N
XLogP2.14
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.39
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methoxy-3-sulfamoylphenyl)-1-benzofuran-2-carboxamide
CID 26929619
tert-butyl N-[2-methoxy-5-(quinoline-2-carbonylamino)phenyl]carbamate
CID 55654804
N-(3,4,5-trimethoxyphenyl)quinoline-2-carboxamide
CID 17410358
N-(4-methoxy-3-sulfamoylphenyl)thiadiazole-4-carboxamide
CID 61068916
N-[4,5-dimethoxy-2-(quinoline-2-carbonylamino)phenyl]quinoline-2-carboxamide
CID 91594053
N-[4-methyl-3-(methylsulfamoyl)phenyl]quinoline-2-carboxamide
CID 9107051
N-(4-methoxy-3-sulfamoylphenyl)-2H-triazole-4-carboxamide
CID 112733236
3,5-dichloro-N-(4-methoxy-3-sulfamoylphenyl)benzamide
CID 26929610
N-(4-methoxy-3-sulfamoylphenyl)-2-thiophen-2-yl-1,3-thiazole-4-carboxamide
CID 24514747
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
N-(4-methoxy-3-sulfamoylphenyl)-3-phenyl-1H-pyrazole-5-carboxamide
CID 8889356
N-(3,4-dichlorophenyl)-4-methoxy-3-sulfamoylbenzamide
CID 36859467

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide?
The IUPAC name of N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide (CID 4789220) is N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide.
What is the SMILES notation for N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide?
The canonical SMILES for N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide is COc1ccc(NC(=O)c2ccc3ccccc3n2)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide?
The InChIKey is DTEMUADBXUTSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O4S/c1-24-15-9-7-12(10-16(15)25(18,22)23)19-17(21)14-8-6-11-4-2-3-5-13(11)20-14/h2-10H,1H3,(H,19,21)(H2,18,22,23).
What are the key properties of N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide?
N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide has a molecular weight of 357.39 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-sulfamoylphenyl)quinoline-2-carboxamide is sourced from PubChem (CID 4789220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).