4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide

C24H32N2O4S — CID 42997848

IUPAC4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2c(C)cc(C)cc2C)cc1S(=O)(=O)NC1CCCCC1C
InChIInChI=1S/C24H32N2O4S/c1-15-12-17(3)23(18(4)13-15)25-24(27)19-10-11-21(30-5)22(14-19)31(28,29)26-20-9-7-6-8-16(20)2/h10-14,16,20,26H,6-9H2,1-5H3,(H,25,27)
InChIKeyBHGIUHYGNCRDSB-UHFFFAOYSA-N
MW444.60 g/mol
LogP4.73
Rot. Bonds6

About 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide

4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide (PubChem CID 42997848) has the molecular formula C24H32N2O4S and a molecular weight of 444.60 g/mol. Its IUPAC name is 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide.

Molecular Properties

Compound Name4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide
PubChem CID42997848
Molecular FormulaC24H32N2O4S
Molecular Weight444.60 g/mol
Exact Mass444.21
IUPAC Name4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide
SMILESCOc1ccc(C(=O)Nc2c(C)cc(C)cc2C)cc1S(=O)(=O)NC1CCCCC1C
InChIInChI=1S/C24H32N2O4S/c1-15-12-17(3)23(18(4)13-15)25-24(27)19-10-11-21(30-5)22(14-19)31(28,29)26-20-9-7-6-8-16(20)2/h10-14,16,20,26H,6-9H2,1-5H3,(H,25,27)
InChIKeyBHGIUHYGNCRDSB-UHFFFAOYSA-N
XLogP4.73
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.60
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methoxy-5-methylphenyl)-4-methoxy-3-[[(1S,2S)-2-methylcyclohexyl]sulfamoyl]benzamide
CID 2565157
N-(5-chloro-2-methoxyphenyl)-4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]benzamide
CID 42997457
4-methoxy-3-[[(1R,2S)-2-methylcyclohexyl]sulfamoyl]benzoate
CID 2466564
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(4-piperidin-1-ylphenyl)benzamide
CID 16552462
4-methoxy-3-[[(1S,2S)-2-methylcyclohexyl]sulfamoyl]-N-prop-2-enylbenzamide
CID 30282957
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 46644366
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2-methyl-3-nitrophenyl)benzamide
CID 43012308
2-methoxy-4,5-dimethyl-N-(2-methylcyclohexyl)benzenesulfonamide
CID 2984852
cyanomethyl 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]benzoate
CID 46607885
N-(4-bromo-2,6-dimethylphenyl)-4-methoxy-3-(propan-2-ylsulfamoyl)benzamide
CID 100795511
2,5-dimethoxy-N-[(1R,2R)-2-methylcyclohexyl]benzenesulfonamide
CID 768909
2-methoxy-N-(2-methylcyclohexyl)-5-[(quinoline-2-carbonylamino)carbamoyl]benzenesulfonamide
CID 46522904

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide?
The IUPAC name of 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide (CID 42997848) is 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide.
What is the SMILES notation for 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide?
The canonical SMILES for 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide is COc1ccc(C(=O)Nc2c(C)cc(C)cc2C)cc1S(=O)(=O)NC1CCCCC1C.
What is the InChIKey of 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide?
The InChIKey is BHGIUHYGNCRDSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32N2O4S/c1-15-12-17(3)23(18(4)13-15)25-24(27)19-10-11-21(30-5)22(14-19)31(28,29)26-20-9-7-6-8-16(20)2/h10-14,16,20,26H,6-9H2,1-5H3,(H,25,27).
What are the key properties of 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide?
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide has a molecular weight of 444.60 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-(2,4,6-trimethylphenyl)benzamide is sourced from PubChem (CID 42997848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).