N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide

C20H24N2O3S — CID 126811243

IUPACN-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
SMILESCN(C(=O)C[C@@H]1C[C@H]1c1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C20H24N2O3S/c1-21(2)26(24,25)18-11-9-17(10-12-18)22(3)20(23)14-16-13-19(16)15-7-5-4-6-8-15/h4-12,16,19H,13-14H2,1-3H3/t16-,19-/m0/s1
InChIKeySXZTVFGTEKNWEV-LPHOPBHVSA-N
MW372.49 g/mol
LogP3.09
Rot. Bonds6

About N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide

N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide (PubChem CID 126811243) has the molecular formula C20H24N2O3S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide.

Molecular Properties

Compound NameN-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
PubChem CID126811243
Molecular FormulaC20H24N2O3S
Molecular Weight372.49 g/mol
Exact Mass372.15
IUPAC NameN-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide
SMILESCN(C(=O)C[C@@H]1C[C@H]1c1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1
InChIInChI=1S/C20H24N2O3S/c1-21(2)26(24,25)18-11-9-17(10-12-18)22(3)20(23)14-16-13-19(16)15-7-5-4-6-8-15/h4-12,16,19H,13-14H2,1-3H3/t16-,19-/m0/s1
InChIKeySXZTVFGTEKNWEV-LPHOPBHVSA-N
XLogP3.09
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.49
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
The IUPAC name of N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide (CID 126811243) is N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide.
What is the SMILES notation for N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
The canonical SMILES for N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide is CN(C(=O)C[C@@H]1C[C@H]1c1ccccc1)c1ccc(S(=O)(=O)N(C)C)cc1.
What is the InChIKey of N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
The InChIKey is SXZTVFGTEKNWEV-LPHOPBHVSA-N. The full InChI is InChI=1S/C20H24N2O3S/c1-21(2)26(24,25)18-11-9-17(10-12-18)22(3)20(23)14-16-13-19(16)15-7-5-4-6-8-15/h4-12,16,19H,13-14H2,1-3H3/t16-,19-/m0/s1.
What are the key properties of N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide?
N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide has a molecular weight of 372.49 g/mol, XLogP of 3.09, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylsulfamoyl)phenyl]-N-methyl-2-[(1S,2R)-2-phenylcyclopropyl]acetamide is sourced from PubChem (CID 126811243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).