2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide

C18H26N2O3S — CID 24646892

IUPAC2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
SMILESCNS(=O)(=O)c1cc(NC(=O)C2C(C=C(C)C)C2(C)C)ccc1C
InChIInChI=1S/C18H26N2O3S/c1-11(2)9-14-16(18(14,4)5)17(21)20-13-8-7-12(3)15(10-13)24(22,23)19-6/h7-10,14,16,19H,1-6H3,(H,20,21)
InChIKeyLFQRRHQHQGTVOP-UHFFFAOYSA-N
MW350.48 g/mol
LogP3.08
Rot. Bonds5

About 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide

2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide (PubChem CID 24646892) has the molecular formula C18H26N2O3S and a molecular weight of 350.48 g/mol. Its IUPAC name is 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
PubChem CID24646892
Molecular FormulaC18H26N2O3S
Molecular Weight350.48 g/mol
Exact Mass350.17
IUPAC Name2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
SMILESCNS(=O)(=O)c1cc(NC(=O)C2C(C=C(C)C)C2(C)C)ccc1C
InChIInChI=1S/C18H26N2O3S/c1-11(2)9-14-16(18(14,4)5)17(21)20-13-8-7-12(3)15(10-13)24(22,23)19-6/h7-10,14,16,19H,1-6H3,(H,20,21)
InChIKeyLFQRRHQHQGTVOP-UHFFFAOYSA-N
XLogP3.08
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.48
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide 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-(3-acetamidophenyl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 18150617
2,2-dimethyl-3-(2-methylprop-1-enyl)-N-pyridin-4-ylcyclopropane-1-carboxamide
CID 47141132
N-(4-fluorophenyl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 47014952
cis-(1R,3R)-N-(2,5-dimethylphenyl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 27146525
N-dibenzofuran-3-yl-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 4916063
N-[4-methyl-3-(methylsulfamoyl)phenyl]cyclohexanecarboxamide
CID 78788592
trans-(1S,3S)-N-(3-chloro-4-methylphenyl)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 706303
N-tert-butyl-4-[[(1S,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropanecarbonyl]amino]benzamide
CID 38256775
N-(9H-fluoren-2-yl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 17139231
2,2-dimethyl-N-(2-methylphenyl)-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 24534677
N-[4-methyl-3-(methylsulfamoyl)phenyl]pyrrolidine-2-carboxamide
CID 43233916
2-amino-2-methyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]propanamide
CID 61265605

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
The IUPAC name of 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide (CID 24646892) is 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide is CNS(=O)(=O)c1cc(NC(=O)C2C(C=C(C)C)C2(C)C)ccc1C.
What is the InChIKey of 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
The InChIKey is LFQRRHQHQGTVOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O3S/c1-11(2)9-14-16(18(14,4)5)17(21)20-13-8-7-12(3)15(10-13)24(22,23)19-6/h7-10,14,16,19H,1-6H3,(H,20,21).
What are the key properties of 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide?
2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide has a molecular weight of 350.48 g/mol, XLogP of 3.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[4-methyl-3-(methylsulfamoyl)phenyl]-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 24646892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).