N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide

C16H21Cl2NO3S — CID 154754123

IUPACN-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide
SMILESCC1(C)CCC(S(=O)(=O)CC(=O)Nc2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C16H21Cl2NO3S/c1-16(2)7-5-12(6-8-16)23(21,22)10-15(20)19-14-4-3-11(17)9-13(14)18/h3-4,9,12H,5-8,10H2,1-2H3,(H,19,20)
InChIKeyDWOZVVVUKDNEAP-UHFFFAOYSA-N
MW378.32 g/mol
LogP4.32
Rot. Bonds4

About N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide

N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide (PubChem CID 154754123) has the molecular formula C16H21Cl2NO3S and a molecular weight of 378.32 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide
PubChem CID154754123
Molecular FormulaC16H21Cl2NO3S
Molecular Weight378.32 g/mol
Exact Mass377.06
IUPAC NameN-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide
SMILESCC1(C)CCC(S(=O)(=O)CC(=O)Nc2ccc(Cl)cc2Cl)CC1
InChIInChI=1S/C16H21Cl2NO3S/c1-16(2)7-5-12(6-8-16)23(21,22)10-15(20)19-14-4-3-11(17)9-13(14)18/h3-4,9,12H,5-8,10H2,1-2H3,(H,19,20)
InChIKeyDWOZVVVUKDNEAP-UHFFFAOYSA-N
XLogP4.32
TPSA63.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.32
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,4-dichlorophenyl)propanamide
CID 923083
2-(cyanomethylsulfonyl)-N-(2,4-dichlorophenyl)acetamide
CID 96694943
N-(4-amino-2-methylphenyl)-2-cyclopentylsulfonylacetamide
CID 63115519
N-(4-amino-2-methylphenyl)-2-cyclohexylsulfonylacetamide
CID 60886370
2-(cyclopentylamino)-N-(2,4-dichlorophenyl)acetamide
CID 9465920
3-(cyclopropylamino)-N-(2,4-dichlorophenyl)propanamide
CID 60722944
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(2,4-dichlorophenyl)acetamide
CID 1330087
N-(2,4-dichlorophenyl)-2-[(2R)-2-methylpiperidin-1-ium-1-yl]acetamide
CID 2655213
N-(2,4-dichlorophenyl)-2-(5,6,7,8-tetrahydroisoquinolin-2-ium-2-yl)acetamide
CID 8877205
N-(2,4-dichlorophenyl)-3,3-dimethylbutanamide
CID 884679
N-(2,4-dichlorophenyl)-2-methoxyacetamide
CID 885676
N-(4-chloro-2-methylphenyl)-N'-(2,4-dichlorophenyl)propanediamide
CID 108955225

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide (CID 154754123) is N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide is CC1(C)CCC(S(=O)(=O)CC(=O)Nc2ccc(Cl)cc2Cl)CC1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide?
The InChIKey is DWOZVVVUKDNEAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21Cl2NO3S/c1-16(2)7-5-12(6-8-16)23(21,22)10-15(20)19-14-4-3-11(17)9-13(14)18/h3-4,9,12H,5-8,10H2,1-2H3,(H,19,20).
What are the key properties of N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide?
N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide has a molecular weight of 378.32 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-(4,4-dimethylcyclohexyl)sulfonylacetamide is sourced from PubChem (CID 154754123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).