1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea

C11H17N3O3S2 — CID 167969155

IUPAC1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea
SMILESCN(C(=O)Nc1nccs1)C1CCCC1S(C)(=O)=O
InChIInChI=1S/C11H17N3O3S2/c1-14(11(15)13-10-12-6-7-18-10)8-4-3-5-9(8)19(2,16)17/h6-9H,3-5H2,1-2H3,(H,12,13,15)
InChIKeyVGWIDECBOSMVLP-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.57
Rot. Bonds3

About 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea

1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea (PubChem CID 167969155) has the molecular formula C11H17N3O3S2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea.

Molecular Properties

Compound Name1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea
PubChem CID167969155
Molecular FormulaC11H17N3O3S2
Molecular Weight303.41 g/mol
Exact Mass303.07
IUPAC Name1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea
SMILESCN(C(=O)Nc1nccs1)C1CCCC1S(C)(=O)=O
InChIInChI=1S/C11H17N3O3S2/c1-14(11(15)13-10-12-6-7-18-10)8-4-3-5-9(8)19(2,16)17/h6-9H,3-5H2,1-2H3,(H,12,13,15)
InChIKeyVGWIDECBOSMVLP-UHFFFAOYSA-N
XLogP1.57
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea 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

4-[cyclopentyl(methyl)sulfamoyl]-N-(1,3-thiazol-2-yl)benzamide
CID 7656045
1-ethyl-1-methyl-3-(1,3-thiazol-2-yl)urea
CID 115603490
1-(1-acetylpiperidin-4-yl)-1-cyclohexyl-3-(1,3-thiazol-2-yl)urea;ethane
CID 91342895
1-methyl-1-nitroso-3-(1,3-thiazol-2-yl)urea;dihydrochloride
CID 174438670
1-methyl-1-phenyl-3-(1,3-thiazol-2-yl)urea
CID 34880183
2-[methyl(1,3-thiazol-2-ylcarbamoyl)amino]propanoic acid
CID 62625896
2-oxo-N-(1,3-thiazol-2-yl)-2-(1,3,3-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)acetamide
CID 108520035
2-cyclopentyl-N-(1,3-thiazol-2-yl)propanamide
CID 141028315
1-methyl-1-prop-2-enyl-3-(1,3-thiazol-2-yl)urea
CID 131176329
cis-(1R,2S)-3-methylidene-1-N,2-N-bis(1,3-thiazol-2-yl)cyclopropane-1,2-dicarboxamide
CID 2313436
(2S)-1-(diethylsulfamoyl)-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 95274519
1-cyclopropyl-3-(1,3-thiazol-2-yl)urea
CID 108887577

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea?
The IUPAC name of 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea (CID 167969155) is 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea.
What is the SMILES notation for 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea?
The canonical SMILES for 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea is CN(C(=O)Nc1nccs1)C1CCCC1S(C)(=O)=O.
What is the InChIKey of 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea?
The InChIKey is VGWIDECBOSMVLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S2/c1-14(11(15)13-10-12-6-7-18-10)8-4-3-5-9(8)19(2,16)17/h6-9H,3-5H2,1-2H3,(H,12,13,15).
What are the key properties of 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea?
1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea has a molecular weight of 303.41 g/mol, XLogP of 1.57, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-(2-methylsulfonylcyclopentyl)-3-(1,3-thiazol-2-yl)urea is sourced from PubChem (CID 167969155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).