N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide

C17H26N2O4S — CID 17490358

IUPACN-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide
SMILESCON(C)S(=O)(=O)c1ccc(C(=O)NC2CCCCCCC2)cc1
InChIInChI=1S/C17H26N2O4S/c1-19(23-2)24(21,22)16-12-10-14(11-13-16)17(20)18-15-8-6-4-3-5-7-9-15/h10-13,15H,3-9H2,1-2H3,(H,18,20)
InChIKeyPPPCZTUAAHGHOC-UHFFFAOYSA-N
MW354.47 g/mol
LogP2.71
Rot. Bonds5

About N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide

N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide (PubChem CID 17490358) has the molecular formula C17H26N2O4S and a molecular weight of 354.47 g/mol. Its IUPAC name is N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide
PubChem CID17490358
Molecular FormulaC17H26N2O4S
Molecular Weight354.47 g/mol
Exact Mass354.16
IUPAC NameN-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide
SMILESCON(C)S(=O)(=O)c1ccc(C(=O)NC2CCCCCCC2)cc1
InChIInChI=1S/C17H26N2O4S/c1-19(23-2)24(21,22)16-12-10-14(11-13-16)17(20)18-15-8-6-4-3-5-7-9-15/h10-13,15H,3-9H2,1-2H3,(H,18,20)
InChIKeyPPPCZTUAAHGHOC-UHFFFAOYSA-N
XLogP2.71
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.47
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-[methoxy(methyl)sulfamoyl]benzamide
CID 46463867
4-chloro-N-cyclooctyl-3-[methoxy(methyl)sulfamoyl]benzamide
CID 26244416
N-[cyclohexyl(phenyl)methyl]-4-[methoxy(methyl)sulfamoyl]benzamide
CID 55690038
N-cycloheptyl-4-(dipropylsulfamoyl)benzamide
CID 109061201
N-cyclohexyl-4-(2-methoxyethylsulfamoyl)benzamide
CID 51297166
N-cyclopentyl-4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzamide
CID 1294119
methyl 4-[methoxy(methyl)sulfamoyl]benzoate
CID 35459995
N-cyclohexyl-4-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 94664243
4-[[(4-tert-butylbenzoyl)amino]carbamoyl]-N-methoxy-N-methylbenzenesulfonamide
CID 9327451
N-cyclooctyl-4-methylbenzamide
CID 3995245
4-(tert-butylsulfamoyl)-N-cyclopentylbenzamide
CID 18106170
4-[methoxy(methyl)sulfamoyl]-N-(4-methylpiperazin-1-yl)benzamide
CID 9205648

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide?
The IUPAC name of N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide (CID 17490358) is N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide.
What is the SMILES notation for N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide?
The canonical SMILES for N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide is CON(C)S(=O)(=O)c1ccc(C(=O)NC2CCCCCCC2)cc1.
What is the InChIKey of N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide?
The InChIKey is PPPCZTUAAHGHOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4S/c1-19(23-2)24(21,22)16-12-10-14(11-13-16)17(20)18-15-8-6-4-3-5-7-9-15/h10-13,15H,3-9H2,1-2H3,(H,18,20).
What are the key properties of N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide?
N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide has a molecular weight of 354.47 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-4-[methoxy(methyl)sulfamoyl]benzamide is sourced from PubChem (CID 17490358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).