5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one

C16H24N2OS2 — CID 103065430

IUPAC5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
SMILESCc1ccc(C2NC(CC(C)C)C(=O)N2C2CCSC2)s1
InChIInChI=1S/C16H24N2OS2/c1-10(2)8-13-16(19)18(12-6-7-20-9-12)15(17-13)14-5-4-11(3)21-14/h4-5,10,12-13,15,17H,6-9H2,1-3H3
InChIKeyNPGWYNJBMJTSOU-UHFFFAOYSA-N
MW324.52 g/mol
LogP3.41
Rot. Bonds4

About 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one

5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one (PubChem CID 103065430) has the molecular formula C16H24N2OS2 and a molecular weight of 324.52 g/mol. Its IUPAC name is 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one.

Molecular Properties

Compound Name5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
PubChem CID103065430
Molecular FormulaC16H24N2OS2
Molecular Weight324.52 g/mol
Exact Mass324.13
IUPAC Name5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
SMILESCc1ccc(C2NC(CC(C)C)C(=O)N2C2CCSC2)s1
InChIInChI=1S/C16H24N2OS2/c1-10(2)8-13-16(19)18(12-6-7-20-9-12)15(17-13)14-5-4-11(3)21-14/h4-5,10,12-13,15,17H,6-9H2,1-3H3
InChIKeyNPGWYNJBMJTSOU-UHFFFAOYSA-N
XLogP3.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.52
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one 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

5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065521
5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83242881
5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-pentylimidazolidin-4-one
CID 83246232
2-(5-methylthiophen-2-yl)-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83245482
3-cyclopropyl-2-(2-methylphenyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83243067
3-(1-methylpyrrolidin-3-yl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83252605
3-cyclopropyl-5-(2-methylpropyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83242971
3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243481
5-methyl-3-(1-methylpiperidin-4-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83244068
3-(2-methylpropyl)-1-(thiolan-3-yl)-1,4-diazepane-2,5-dione
CID 103065096
3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83264047
2,5-diethyl-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065473

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
The IUPAC name of 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one (CID 103065430) is 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one.
What is the SMILES notation for 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
The canonical SMILES for 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one is Cc1ccc(C2NC(CC(C)C)C(=O)N2C2CCSC2)s1.
What is the InChIKey of 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
The InChIKey is NPGWYNJBMJTSOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS2/c1-10(2)8-13-16(19)18(12-6-7-20-9-12)15(17-13)14-5-4-11(3)21-14/h4-5,10,12-13,15,17H,6-9H2,1-3H3.
What are the key properties of 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one has a molecular weight of 324.52 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one is sourced from PubChem (CID 103065430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).