N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide

C23H25N3O5S — CID 15990893

IUPACN-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
SMILESCOc1cccc(NS(=O)(=O)c2ccc3[nH]cc(C(=O)NC4CCCCC4)c(=O)c3c2)c1
InChIInChI=1S/C23H25N3O5S/c1-31-17-9-5-8-16(12-17)26-32(29,30)18-10-11-21-19(13-18)22(27)20(14-24-21)23(28)25-15-6-3-2-4-7-15/h5,8-15,26H,2-4,6-7H2,1H3,(H,24,27)(H,25,28)
InChIKeyXVLYZGWQRQMPJN-UHFFFAOYSA-N
MW455.54 g/mol
LogP3.40
Rot. Bonds6

About N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide

N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide (PubChem CID 15990893) has the molecular formula C23H25N3O5S and a molecular weight of 455.54 g/mol. Its IUPAC name is N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
PubChem CID15990893
Molecular FormulaC23H25N3O5S
Molecular Weight455.54 g/mol
Exact Mass455.15
IUPAC NameN-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide
SMILESCOc1cccc(NS(=O)(=O)c2ccc3[nH]cc(C(=O)NC4CCCCC4)c(=O)c3c2)c1
InChIInChI=1S/C23H25N3O5S/c1-31-17-9-5-8-16(12-17)26-32(29,30)18-10-11-21-19(13-18)22(27)20(14-24-21)23(28)25-15-6-3-2-4-7-15/h5,8-15,26H,2-4,6-7H2,1H3,(H,24,27)(H,25,28)
InChIKeyXVLYZGWQRQMPJN-UHFFFAOYSA-N
XLogP3.40
TPSA117.36 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500455.54
LogP ≤ 53.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

Sulfonamide-01
CID 11532283
2-[3-(Diethylsulfamoyl)benzamido]-N-(4-methoxyphenyl)benzamide
CID 4651552
4-fluoro-N-(3-methoxyphenyl)-3-(piperidin-1-ylsulfonyl)benzamide
CID 26914637
2-(4-Methoxy-benzenesulfonylamino)-N-((S)-1-phenyl-propyl)-benzamide
CID 44327937
N-(3-methoxyphenyl)-2-oxo-3,4-dihydro-1H-quinoline-6-sulfonamide
CID 3638189
N-[2-(4-methoxyphenyl)ethyl]-2-[methyl(phenylsulfonyl)amino]benzamide
CID 1298197
N-[2-(4-methoxyphenyl)ethyl]-4-{methyl[(4-methylphenyl)sulfonyl]amino}benzamide
CID 2198187
N-[(2-methoxyphenyl)methyl]-3-[methyl(phenyl)sulfamoyl]benzamide
CID 2713335
6-{[(4-ethoxyphenyl)amino]sulfonyl}-N,N-diethyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 3236487
N-(3-isopropoxypropyl)-6-{[(3-methoxyphenyl)amino]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 3238410
N-(2-furylmethyl)-N-methyl-6-{[(2-methylphenyl)amino]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 3239329
N-(3-ethoxypropyl)-6-{[(3-methoxyphenyl)amino]sulfonyl}-4-oxo-1,4-dihydroquinoline-3-carboxamide
CID 3239829

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide (CID 15990893) is N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide is COc1cccc(NS(=O)(=O)c2ccc3[nH]cc(C(=O)NC4CCCCC4)c(=O)c3c2)c1.
What is the InChIKey of N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide?
The InChIKey is XVLYZGWQRQMPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O5S/c1-31-17-9-5-8-16(12-17)26-32(29,30)18-10-11-21-19(13-18)22(27)20(14-24-21)23(28)25-15-6-3-2-4-7-15/h5,8-15,26H,2-4,6-7H2,1H3,(H,24,27)(H,25,28).
What are the key properties of N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide?
N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide has a molecular weight of 455.54 g/mol, XLogP of 3.40, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-6-[(3-methoxyphenyl)sulfamoyl]-4-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 15990893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).