4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide

C16H23ClN2O3S — CID 43000186

IUPAC4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide
SMILESCC1CCC(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)CC1
InChIInChI=1S/C16H23ClN2O3S/c1-11-4-7-13(8-5-11)18-16(20)12-6-9-14(17)15(10-12)23(21,22)19(2)3/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,18,20)
InChIKeyNMDDMNYSJPEPKD-UHFFFAOYSA-N
MW358.89 g/mol
LogP2.90
Rot. Bonds4

About 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide

4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide (PubChem CID 43000186) has the molecular formula C16H23ClN2O3S and a molecular weight of 358.89 g/mol. Its IUPAC name is 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide
PubChem CID43000186
Molecular FormulaC16H23ClN2O3S
Molecular Weight358.89 g/mol
Exact Mass358.11
IUPAC Name4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide
SMILESCC1CCC(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)CC1
InChIInChI=1S/C16H23ClN2O3S/c1-11-4-7-13(8-5-11)18-16(20)12-6-9-14(17)15(10-12)23(21,22)19(2)3/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,18,20)
InChIKeyNMDDMNYSJPEPKD-UHFFFAOYSA-N
XLogP2.90
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.89
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(dimethylsulfamoyl)-4-methoxy-N-(4-methylcyclohexyl)benzamide
CID 26877374
4-chloro-N-cyclopropyl-3-(methylsulfamoyl)benzamide
CID 9165471
4-chloro-N-cyclooctyl-3-[methoxy(methyl)sulfamoyl]benzamide
CID 26244416
N-butyl-4-chloro-3-(dimethylsulfamoyl)benzamide
CID 35709594
4-chloro-N-cyclohexyl-3-methylsulfonylbenzamide
CID 17456227
4-chloro-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-3-(dimethylsulfamoyl)benzamide
CID 41041121
4-chloro-3-(dimethylsulfamoyl)-N-propan-2-ylbenzamide
CID 34234138
N-[4-[1-(4-bromo-3-chlorophenyl)triazol-4-yl]cyclohexyl]-4-chloro-3-(dimethylsulfamoyl)benzamide
CID 166347135
4-chloro-N-cyclopentyl-3-(methylsulfamoyl)benzamide
CID 9213864
3-(cyclopropylsulfamoyl)-4-fluoro-N-(4-methylcyclohexyl)benzamide
CID 31966533
4-chloro-3-(dimethylsulfamoyl)-N-(1-methylcyclopent-3-en-1-yl)benzamide
CID 127266645
4-chloro-N-[4-(cyclopropylcarbamoylamino)phenyl]-3-[methoxy(methyl)sulfamoyl]benzamide
CID 55532770

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide?
The IUPAC name of 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide (CID 43000186) is 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide.
What is the SMILES notation for 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide?
The canonical SMILES for 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide is CC1CCC(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)CC1.
What is the InChIKey of 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide?
The InChIKey is NMDDMNYSJPEPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O3S/c1-11-4-7-13(8-5-11)18-16(20)12-6-9-14(17)15(10-12)23(21,22)19(2)3/h6,9-11,13H,4-5,7-8H2,1-3H3,(H,18,20).
What are the key properties of 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide?
4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide has a molecular weight of 358.89 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-(dimethylsulfamoyl)-N-(4-methylcyclohexyl)benzamide is sourced from PubChem (CID 43000186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).