N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide

C18H17N3O4S — CID 110324340

IUPACN-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCc2cc3ccccc3[nH]c2=O)cc1
InChIInChI=1S/C18H17N3O4S/c1-12(22)20-15-6-8-16(9-7-15)26(24,25)19-11-14-10-13-4-2-3-5-17(13)21-18(14)23/h2-10,19H,11H2,1H3,(H,20,22)(H,21,23)
InChIKeyWNQJJTTVTJXNQP-UHFFFAOYSA-N
MW371.42 g/mol
LogP1.97
Rot. Bonds5

About N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide

N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide (PubChem CID 110324340) has the molecular formula C18H17N3O4S and a molecular weight of 371.42 g/mol. Its IUPAC name is N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide
PubChem CID110324340
Molecular FormulaC18H17N3O4S
Molecular Weight371.42 g/mol
Exact Mass371.09
IUPAC NameN-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCc2cc3ccccc3[nH]c2=O)cc1
InChIInChI=1S/C18H17N3O4S/c1-12(22)20-15-6-8-16(9-7-15)26(24,25)19-11-14-10-13-4-2-3-5-17(13)21-18(14)23/h2-10,19H,11H2,1H3,(H,20,22)(H,21,23)
InChIKeyWNQJJTTVTJXNQP-UHFFFAOYSA-N
XLogP1.97
TPSA108.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 51.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[methyl-[(2-oxo-1H-quinolin-3-yl)methyl]sulfamoyl]phenyl]acetamide
CID 4902121
1-acetyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 110324349
N-[(2-oxo-1H-quinolin-3-yl)methyl]-1,3-benzodioxole-5-sulfonamide
CID 110324331
4-methyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324590
4-methoxy-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]benzenesulfonamide
CID 110325662
3-[(3-methylbut-2-enylamino)methyl]-1H-quinolin-2-one
CID 103527928
N-[4-(benzenesulfonamidomethyl)phenyl]acetamide
CID 32683830
4-methoxy-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324686
N-[4-[(1,2,5-trimethylpyrrol-3-yl)methylsulfamoyl]phenyl]acetamide
CID 110642115
N-[4-(1-benzothiophen-3-ylmethylsulfamoyl)phenyl]acetamide
CID 2826149
3-methyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzenesulfonamide
CID 110324619
3-[(2-methylbut-3-yn-2-ylamino)methyl]-1H-quinolin-2-one
CID 63999144

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide (CID 110324340) is N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NCc2cc3ccccc3[nH]c2=O)cc1.
What is the InChIKey of N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide?
The InChIKey is WNQJJTTVTJXNQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S/c1-12(22)20-15-6-8-16(9-7-15)26(24,25)19-11-14-10-13-4-2-3-5-17(13)21-18(14)23/h2-10,19H,11H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide?
N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide has a molecular weight of 371.42 g/mol, XLogP of 1.97, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-oxo-1H-quinolin-3-yl)methylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 110324340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).