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

C14H20N2OS2 — CID 103065521

IUPAC5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
SMILESCCC1NC(c2ccc(C)s2)N(C2CCSC2)C1=O
InChIInChI=1S/C14H20N2OS2/c1-3-11-14(17)16(10-6-7-18-8-10)13(15-11)12-5-4-9(2)19-12/h4-5,10-11,13,15H,3,6-8H2,1-2H3
InChIKeyZNFRFCZMCQESFM-UHFFFAOYSA-N
MW296.46 g/mol
LogP2.77
Rot. Bonds3

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

5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one (PubChem CID 103065521) has the molecular formula C14H20N2OS2 and a molecular weight of 296.46 g/mol. Its IUPAC name is 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
PubChem CID103065521
Molecular FormulaC14H20N2OS2
Molecular Weight296.46 g/mol
Exact Mass296.10
IUPAC Name5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
SMILESCCC1NC(c2ccc(C)s2)N(C2CCSC2)C1=O
InChIInChI=1S/C14H20N2OS2/c1-3-11-14(17)16(10-6-7-18-8-10)13(15-11)12-5-4-9(2)19-12/h4-5,10-11,13,15H,3,6-8H2,1-2H3
InChIKeyZNFRFCZMCQESFM-UHFFFAOYSA-N
XLogP2.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.46
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-methylpropyl)-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065430
5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83242881
2,5-diethyl-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065473
2-(5-methylthiophen-2-yl)-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83245482
3-(1-methylpyrrolidin-3-yl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83252605
3-(cyclopentylmethyl)-5-ethyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83244248
3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83264047
3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243481
5-ethyl-3-(4-methylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83239488
3-[2-(dimethylamino)ethyl]-5-ethyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83251342
5-methyl-3-(1-methylpiperidin-4-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83244068
5-ethyl-3-(4-methylpentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83257006

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one (CID 103065521) is 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one is CCC1NC(c2ccc(C)s2)N(C2CCSC2)C1=O.
What is the InChIKey of 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
The InChIKey is ZNFRFCZMCQESFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS2/c1-3-11-14(17)16(10-6-7-18-8-10)13(15-11)12-5-4-9(2)19-12/h4-5,10-11,13,15H,3,6-8H2,1-2H3.
What are the key properties of 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one?
5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one has a molecular weight of 296.46 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one is sourced from PubChem (CID 103065521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).