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

C16H20N2OS2 — CID 83267709

IUPAC3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
SMILESCc1cscc1CN1C(=O)C(C(C)C)NC1c1ccsc1
InChIInChI=1S/C16H20N2OS2/c1-10(2)14-16(19)18(6-13-9-21-7-11(13)3)15(17-14)12-4-5-20-8-12/h4-5,7-10,14-15,17H,6H2,1-3H3
InChIKeyUGGLCCFTAGPSDG-UHFFFAOYSA-N
MW320.48 g/mol
LogP3.77
Rot. Bonds4

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

3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83267709) has the molecular formula C16H20N2OS2 and a molecular weight of 320.48 g/mol. Its IUPAC name is 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83267709
Molecular FormulaC16H20N2OS2
Molecular Weight320.48 g/mol
Exact Mass320.10
IUPAC Name3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
SMILESCc1cscc1CN1C(=O)C(C(C)C)NC1c1ccsc1
InChIInChI=1S/C16H20N2OS2/c1-10(2)14-16(19)18(6-13-9-21-7-11(13)3)15(17-14)12-4-5-20-8-12/h4-5,7-10,14-15,17H,6H2,1-3H3
InChIKeyUGGLCCFTAGPSDG-UHFFFAOYSA-N
XLogP3.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.48
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one with MolForge

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Related Compounds

5-propan-2-yl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242352
3-(4-methylpentan-2-yl)-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83243366
3-hexan-2-yl-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83252691
5-butan-2-yl-3-(2-propan-2-yloxyethyl)-2-thiophen-3-ylimidazolidin-4-one
CID 104767623
5-propan-2-yl-3-(thiolan-3-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 103065506
3-[(4-methylthiophen-3-yl)methyl]-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83271175
3-(2,2-dimethylcyclopentyl)-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83269816
2-cyclopentyl-5-methyl-3-[(4-methylthiophen-3-yl)methyl]imidazolidin-4-one
CID 83271179
3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83257048
5-(2-methylpropyl)-3-[(4-methylthiophen-3-yl)methyl]-2-propylimidazolidin-4-one
CID 83271256
3-(2-methylpropyl)-2-phenyl-5-propan-2-ylimidazolidin-4-one
CID 83242661
5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242612

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one (CID 83267709) is 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one is Cc1cscc1CN1C(=O)C(C(C)C)NC1c1ccsc1.
What is the InChIKey of 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is UGGLCCFTAGPSDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2OS2/c1-10(2)14-16(19)18(6-13-9-21-7-11(13)3)15(17-14)12-4-5-20-8-12/h4-5,7-10,14-15,17H,6H2,1-3H3.
What are the key properties of 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 320.48 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylthiophen-3-yl)methyl]-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83267709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).