N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

C18H25N3O4S2 — CID 27832679

IUPACN-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)Cn2c(C)csc2=O)c1
InChIInChI=1S/C18H25N3O4S2/c1-6-20(7-2)27(24,25)15-8-12(3)14(5)16(9-15)19-17(22)10-21-13(4)11-26-18(21)23/h8-9,11H,6-7,10H2,1-5H3,(H,19,22)
InChIKeyKYLBXFHWPOGPGB-UHFFFAOYSA-N
MW411.55 g/mol
LogP2.50
Rot. Bonds7

About N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 27832679) has the molecular formula C18H25N3O4S2 and a molecular weight of 411.55 g/mol. Its IUPAC name is N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID27832679
Molecular FormulaC18H25N3O4S2
Molecular Weight411.55 g/mol
Exact Mass411.13
IUPAC NameN-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)Cn2c(C)csc2=O)c1
InChIInChI=1S/C18H25N3O4S2/c1-6-20(7-2)27(24,25)15-8-12(3)14(5)16(9-15)19-17(22)10-21-13(4)11-26-18(21)23/h8-9,11H,6-7,10H2,1-5H3,(H,19,22)
InChIKeyKYLBXFHWPOGPGB-UHFFFAOYSA-N
XLogP2.50
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.55
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]propanamide;hydrochloride
CID 119272848
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide
CID 26977901
N-[5-(diethylsulfamoyl)-2-methylphenyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide
CID 7819474
(E)-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enamide
CID 16582954
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]piperidine-4-carboxamide
CID 119272853
2-(6-chloro-3-pyridinyl)-N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]acetamide
CID 86933475
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 27832563
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 17446514
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]pyrrolidine-3-carboxamide
CID 119692557
2-chloro-N-[5-(diethylsulfamoyl)-2-methylphenyl]acetamide
CID 3606084
N-(2-amino-4-fluorophenyl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 43287065
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-1-methylsulfonylpiperidine-2-carboxamide
CID 43049414

Frequently Asked Questions

What is the IUPAC name of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (CID 27832679) is N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)Cn2c(C)csc2=O)c1.
What is the InChIKey of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is KYLBXFHWPOGPGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O4S2/c1-6-20(7-2)27(24,25)15-8-12(3)14(5)16(9-15)19-17(22)10-21-13(4)11-26-18(21)23/h8-9,11H,6-7,10H2,1-5H3,(H,19,22).
What are the key properties of N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 411.55 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(diethylsulfamoyl)-2,3-dimethylphenyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 27832679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).