N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine

C15H22Cl2N2O2S — CID 55565324

IUPACN-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine
SMILESCN(Cc1cccc(Cl)c1Cl)S(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C15H22Cl2N2O2S/c1-18(11-12-7-6-10-14(16)15(12)17)22(20,21)19(2)13-8-4-3-5-9-13/h6-7,10,13H,3-5,8-9,11H2,1-2H3
InChIKeyFOVZFSLDNFSAKY-UHFFFAOYSA-N
MW365.33 g/mol
LogP3.93
Rot. Bonds5

About N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine

N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine (PubChem CID 55565324) has the molecular formula C15H22Cl2N2O2S and a molecular weight of 365.33 g/mol. Its IUPAC name is N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine.

Molecular Properties

Compound NameN-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine
PubChem CID55565324
Molecular FormulaC15H22Cl2N2O2S
Molecular Weight365.33 g/mol
Exact Mass364.08
IUPAC NameN-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine
SMILESCN(Cc1cccc(Cl)c1Cl)S(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C15H22Cl2N2O2S/c1-18(11-12-7-6-10-14(16)15(12)17)22(20,21)19(2)13-8-4-3-5-9-13/h6-7,10,13H,3-5,8-9,11H2,1-2H3
InChIKeyFOVZFSLDNFSAKY-UHFFFAOYSA-N
XLogP3.93
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.33
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine?
The IUPAC name of N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine (CID 55565324) is N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine.
What is the SMILES notation for N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine?
The canonical SMILES for N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine is CN(Cc1cccc(Cl)c1Cl)S(=O)(=O)N(C)C1CCCCC1.
What is the InChIKey of N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine?
The InChIKey is FOVZFSLDNFSAKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2O2S/c1-18(11-12-7-6-10-14(16)15(12)17)22(20,21)19(2)13-8-4-3-5-9-13/h6-7,10,13H,3-5,8-9,11H2,1-2H3.
What are the key properties of N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine?
N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine has a molecular weight of 365.33 g/mol, XLogP of 3.93, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dichlorophenyl)methyl-methylsulfamoyl]-N-methylcyclohexanamine is sourced from PubChem (CID 55565324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).