3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide

C17H23N3O3S2 — CID 55903626

IUPAC3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide
SMILESCCCc1nc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)sc1CC
InChIInChI=1S/C17H23N3O3S2/c1-5-8-14-15(6-2)24-17(18-14)19-16(21)12-9-7-10-13(11-12)25(22,23)20(3)4/h7,9-11H,5-6,8H2,1-4H3,(H,18,19,21)
InChIKeyRNQQXZMSMUJQRY-UHFFFAOYSA-N
MW381.52 g/mol
LogP3.16
Rot. Bonds7

About 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide

3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide (PubChem CID 55903626) has the molecular formula C17H23N3O3S2 and a molecular weight of 381.52 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide
PubChem CID55903626
Molecular FormulaC17H23N3O3S2
Molecular Weight381.52 g/mol
Exact Mass381.12
IUPAC Name3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide
SMILESCCCc1nc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)sc1CC
InChIInChI=1S/C17H23N3O3S2/c1-5-8-14-15(6-2)24-17(18-14)19-16(21)12-9-7-10-13(11-12)25(22,23)20(3)4/h7,9-11H,5-6,8H2,1-4H3,(H,18,19,21)
InChIKeyRNQQXZMSMUJQRY-UHFFFAOYSA-N
XLogP3.16
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)-4-(methylsulfamoyl)benzamide
CID 55954055
N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 47064687
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-3-(dimethylsulfamoyl)benzamide
CID 2460785
3-(dimethylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
CID 4030304
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(dimethylsulfamoyl)benzamide
CID 32864912
3-(dimethylsulfamoyl)-N-(6-phenoxy-1,3-benzothiazol-2-yl)benzamide
CID 4800277
3-(diethylsulfamoyl)-N-(4,5,6,7,8,9-hexahydrocycloocta[d][1,3]thiazol-2-yl)benzamide
CID 60571694
N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(dimethylsulfamoyl)benzamide
CID 17439101
3-[methyl(propan-2-yl)sulfamoyl]-N-(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide
CID 46564547
N-[6-(dimethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitrobenzamide
CID 4075249
3-(diethylsulfamoyl)-N-(5-pentyl-1,3,4-thiadiazol-2-yl)benzamide
CID 8839583
N-(3-bromophenyl)-3-(dimethylsulfamoyl)benzamide
CID 2221562

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide (CID 55903626) is 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide is CCCc1nc(NC(=O)c2cccc(S(=O)(=O)N(C)C)c2)sc1CC.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is RNQQXZMSMUJQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3S2/c1-5-8-14-15(6-2)24-17(18-14)19-16(21)12-9-7-10-13(11-12)25(22,23)20(3)4/h7,9-11H,5-6,8H2,1-4H3,(H,18,19,21).
What are the key properties of 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide?
3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 381.52 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(5-ethyl-4-propyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 55903626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).