5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one

C12H18N2OS — CID 83242612

IUPAC5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCN1C(=O)C(CC)NC1c1ccsc1
InChIInChI=1S/C12H18N2OS/c1-3-6-14-11(9-5-7-16-8-9)13-10(4-2)12(14)15/h5,7-8,10-11,13H,3-4,6H2,1-2H3
InChIKeyPQRINZOHQLJARY-UHFFFAOYSA-N
MW238.36 g/mol
LogP2.37
Rot. Bonds4

About 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one

5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83242612) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83242612
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCN1C(=O)C(CC)NC1c1ccsc1
InChIInChI=1S/C12H18N2OS/c1-3-6-14-11(9-5-7-16-8-9)13-10(4-2)12(14)15/h5,7-8,10-11,13H,3-4,6H2,1-2H3
InChIKeyPQRINZOHQLJARY-UHFFFAOYSA-N
XLogP2.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one (CID 83242612) is 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one is CCCN1C(=O)C(CC)NC1c1ccsc1.
What is the InChIKey of 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is PQRINZOHQLJARY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-3-6-14-11(9-5-7-16-8-9)13-10(4-2)12(14)15/h5,7-8,10-11,13H,3-4,6H2,1-2H3.
What are the key properties of 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one?
5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 238.36 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83242612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).