3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one

C15H24N2OS — CID 83271175

IUPAC3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)N(Cc2cscc2C)C1=O
InChIInChI=1S/C15H24N2OS/c1-5-6-13-15(18)17(14(16-13)10(2)3)7-12-9-19-8-11(12)4/h8-10,13-14,16H,5-7H2,1-4H3
InChIKeyTVTMWAOCXVUURP-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.14
Rot. Bonds5

About 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one

3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one (PubChem CID 83271175) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
PubChem CID83271175
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)N(Cc2cscc2C)C1=O
InChIInChI=1S/C15H24N2OS/c1-5-6-13-15(18)17(14(16-13)10(2)3)7-12-9-19-8-11(12)4/h8-10,13-14,16H,5-7H2,1-4H3
InChIKeyTVTMWAOCXVUURP-UHFFFAOYSA-N
XLogP3.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-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-(2-methylpropyl)-3-[(4-methylthiophen-3-yl)methyl]-2-propylimidazolidin-4-one
CID 83271256
3-(3-methylbutyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83238566
3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 102915982
3-(2-methylsulfonylethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83256782
3-methyl-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83260226
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
5-ethyl-2-(5-methylthiophen-2-yl)-3-[(4-methylthiophen-3-yl)methyl]imidazolidin-4-one
CID 83267701
3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83267709
2-propan-2-yl-5-propyl-3-(thian-2-ylmethyl)imidazolidin-4-one
CID 83270758
3-[3-[methyl(propan-2-yl)amino]propyl]-2-propan-2-yl-5-propylimidazolidin-4-one
CID 106053040
3-[(1-ethylpiperidin-4-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83252942
5-butyl-2-propan-2-yl-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 104767679

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
The IUPAC name of 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one (CID 83271175) is 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
The canonical SMILES for 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one is CCCC1NC(C(C)C)N(Cc2cscc2C)C1=O.
What is the InChIKey of 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
The InChIKey is TVTMWAOCXVUURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-5-6-13-15(18)17(14(16-13)10(2)3)7-12-9-19-8-11(12)4/h8-10,13-14,16H,5-7H2,1-4H3.
What are the key properties of 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one?
3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one has a molecular weight of 280.44 g/mol, XLogP of 3.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one is sourced from PubChem (CID 83271175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).