3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide

C15H17N3O3S2 — CID 166188646

IUPAC3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C15H17N3O3S2/c19-14(17-15-16-8-9-22-15)11-4-3-7-13(10-11)23(20,21)18-12-5-1-2-6-12/h3-4,7-10,12,18H,1-2,5-6H2,(H,16,17,19)
InChIKeyMZODOAIRJMDPQV-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.62
Rot. Bonds5

About 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide

3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide (PubChem CID 166188646) has the molecular formula C15H17N3O3S2 and a molecular weight of 351.45 g/mol. Its IUPAC name is 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
PubChem CID166188646
Molecular FormulaC15H17N3O3S2
Molecular Weight351.45 g/mol
Exact Mass351.07
IUPAC Name3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide
SMILESO=C(Nc1nccs1)c1cccc(S(=O)(=O)NC2CCCC2)c1
InChIInChI=1S/C15H17N3O3S2/c19-14(17-15-16-8-9-22-15)11-4-3-7-13(10-11)23(20,21)18-12-5-1-2-6-12/h3-4,7-10,12,18H,1-2,5-6H2,(H,16,17,19)
InChIKeyMZODOAIRJMDPQV-UHFFFAOYSA-N
XLogP2.62
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
The IUPAC name of 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide (CID 166188646) is 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide is O=C(Nc1nccs1)c1cccc(S(=O)(=O)NC2CCCC2)c1.
What is the InChIKey of 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
The InChIKey is MZODOAIRJMDPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3S2/c19-14(17-15-16-8-9-22-15)11-4-3-7-13(10-11)23(20,21)18-12-5-1-2-6-12/h3-4,7-10,12,18H,1-2,5-6H2,(H,16,17,19).
What are the key properties of 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide?
3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide has a molecular weight of 351.45 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylsulfamoyl)-N-(1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 166188646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).