N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide

C19H24N2O3S — CID 27832740

IUPACN-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2cc(S(=O)(=O)N(C)C)cc(C)c2C)c1
InChIInChI=1S/C19H24N2O3S/c1-12-7-13(2)9-16(8-12)19(22)20-18-11-17(10-14(3)15(18)4)25(23,24)21(5)6/h7-11H,1-6H3,(H,20,22)
InChIKeyBIGQTYNHRFNAEO-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.42
Rot. Bonds4

About N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide

N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide (PubChem CID 27832740) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide
PubChem CID27832740
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2cc(S(=O)(=O)N(C)C)cc(C)c2C)c1
InChIInChI=1S/C19H24N2O3S/c1-12-7-13(2)9-16(8-12)19(22)20-18-11-17(10-14(3)15(18)4)25(23,24)21(5)6/h7-11H,1-6H3,(H,20,22)
InChIKeyBIGQTYNHRFNAEO-UHFFFAOYSA-N
XLogP3.42
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide (CID 27832740) is N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide is Cc1cc(C)cc(C(=O)Nc2cc(S(=O)(=O)N(C)C)cc(C)c2C)c1.
What is the InChIKey of N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide?
The InChIKey is BIGQTYNHRFNAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-12-7-13(2)9-16(8-12)19(22)20-18-11-17(10-14(3)15(18)4)25(23,24)21(5)6/h7-11H,1-6H3,(H,20,22).
What are the key properties of N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide?
N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide has a molecular weight of 360.48 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(dimethylsulfamoyl)-2,3-dimethylphenyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 27832740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).