3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one

C15H24N2OS2 — CID 83257048

IUPAC3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCC1NC(c2ccsc2)N(CC(C)CSC)C1=O
InChIInChI=1S/C15H24N2OS2/c1-4-5-13-15(18)17(8-11(2)9-19-3)14(16-13)12-6-7-20-10-12/h6-7,10-11,13-14,16H,4-5,8-9H2,1-3H3
InChIKeyYVJUEXAPECXYJQ-UHFFFAOYSA-N
MW312.50 g/mol
LogP3.35
Rot. Bonds7

About 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one

3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83257048) has the molecular formula C15H24N2OS2 and a molecular weight of 312.50 g/mol. Its IUPAC name is 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83257048
Molecular FormulaC15H24N2OS2
Molecular Weight312.50 g/mol
Exact Mass312.13
IUPAC Name3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCC1NC(c2ccsc2)N(CC(C)CSC)C1=O
InChIInChI=1S/C15H24N2OS2/c1-4-5-13-15(18)17(8-11(2)9-19-3)14(16-13)12-6-7-20-10-12/h6-7,10-11,13-14,16H,4-5,8-9H2,1-3H3
InChIKeyYVJUEXAPECXYJQ-UHFFFAOYSA-N
XLogP3.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.50
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-methyl-3-methylsulfanylpropyl)-2-phenyl-5-propylimidazolidin-4-one
CID 83263712
3,5-dipropyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242253
5-butyl-3-[2-(dimethylamino)propyl]-2-thiophen-3-ylimidazolidin-4-one
CID 83252274
3-(2-ethoxyethyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83237977
5-propyl-3-(2,2,3,3-tetrafluoropropyl)-2-thiophen-3-ylimidazolidin-4-one
CID 106291556
3-(cyclobutylmethyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83243416
3-[2-(diethylamino)ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83238183
3-(2-methyl-3-methylsulfanylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83256965
3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83254460
3-[2-(dimethylamino)-2-methylpropyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83253987
3-[4-(dimethylamino)butyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83245135
5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242612

Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one (CID 83257048) is 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one is CCCC1NC(c2ccsc2)N(CC(C)CSC)C1=O.
What is the InChIKey of 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is YVJUEXAPECXYJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS2/c1-4-5-13-15(18)17(8-11(2)9-19-3)14(16-13)12-6-7-20-10-12/h6-7,10-11,13-14,16H,4-5,8-9H2,1-3H3.
What are the key properties of 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 312.50 g/mol, XLogP of 3.35, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-3-methylsulfanylpropyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83257048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).