3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide

C16H24N2O4S — CID 9273168

IUPAC3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide
SMILESCON(C)S(=O)(=O)c1cccc(C(=O)N[C@H]2CCCC[C@@H]2C)c1
InChIInChI=1S/C16H24N2O4S/c1-12-7-4-5-10-15(12)17-16(19)13-8-6-9-14(11-13)23(20,21)18(2)22-3/h6,8-9,11-12,15H,4-5,7,10H2,1-3H3,(H,17,19)/t12-,15-/m0/s1
InChIKeyZAXFXEFEUISDPM-WFASDCNBSA-N
MW340.45 g/mol
LogP2.18
Rot. Bonds5

About 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide

3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide (PubChem CID 9273168) has the molecular formula C16H24N2O4S and a molecular weight of 340.45 g/mol. Its IUPAC name is 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide.

Molecular Properties

Compound Name3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide
PubChem CID9273168
Molecular FormulaC16H24N2O4S
Molecular Weight340.45 g/mol
Exact Mass340.15
IUPAC Name3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide
SMILESCON(C)S(=O)(=O)c1cccc(C(=O)N[C@H]2CCCC[C@@H]2C)c1
InChIInChI=1S/C16H24N2O4S/c1-12-7-4-5-10-15(12)17-16(19)13-8-6-9-14(11-13)23(20,21)18(2)22-3/h6,8-9,11-12,15H,4-5,7,10H2,1-3H3,(H,17,19)/t12-,15-/m0/s1
InChIKeyZAXFXEFEUISDPM-WFASDCNBSA-N
XLogP2.18
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 52.18
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

3-[(2-methoxyphenyl)sulfamoyl]-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 9164421
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-3-[methoxy(methyl)sulfamoyl]benzamide
CID 9193334
N-[(1R,2S)-5-fluoro-2-methyl-1,2,3,4-tetrahydronaphthalen-1-yl]-3-[methoxy(methyl)sulfamoyl]benzamide
CID 96529997
N-[(1R,2S)-2-methylcyclohexyl]-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 9164435
N-[(1R,2R)-2-methylcyclohexyl]-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 9164433
3-methyl-N-[(1S,2S)-2-methylcyclohexyl]benzamide
CID 848103
3-(benzylsulfamoyl)-N-[(1S,2R)-2-methylcyclohexyl]benzamide
CID 9404478
[2-[[(1R,2S)-2-methylcyclohexyl]amino]-2-oxoethyl] 3-[cyclohexyl(methyl)sulfamoyl]benzoate
CID 97092252
3-(2-hydroxypropan-2-yl)-N-(2-methylcyclohexyl)benzamide
CID 110486141
N-[(1R)-2-methylcyclohexyl]benzamide
CID 137472316
N-[cyclopropyl(phenyl)methyl]-3-[methoxy(methyl)sulfamoyl]benzamide
CID 18131655
3-[methoxy(methyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
CID 51250979

Frequently Asked Questions

What is the IUPAC name of 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide?
The IUPAC name of 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide (CID 9273168) is 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide.
What is the SMILES notation for 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide?
The canonical SMILES for 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide is CON(C)S(=O)(=O)c1cccc(C(=O)N[C@H]2CCCC[C@@H]2C)c1.
What is the InChIKey of 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide?
The InChIKey is ZAXFXEFEUISDPM-WFASDCNBSA-N. The full InChI is InChI=1S/C16H24N2O4S/c1-12-7-4-5-10-15(12)17-16(19)13-8-6-9-14(11-13)23(20,21)18(2)22-3/h6,8-9,11-12,15H,4-5,7,10H2,1-3H3,(H,17,19)/t12-,15-/m0/s1.
What are the key properties of 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide?
3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide has a molecular weight of 340.45 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy(methyl)sulfamoyl]-N-[(1S,2S)-2-methylcyclohexyl]benzamide is sourced from PubChem (CID 9273168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).