3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one

C15H25N3OS — CID 83254460

IUPAC3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCC1NC(c2ccsc2)N(CCN(C)CC)C1=O
InChIInChI=1S/C15H25N3OS/c1-4-6-13-15(19)18(9-8-17(3)5-2)14(16-13)12-7-10-20-11-12/h7,10-11,13-14,16H,4-6,8-9H2,1-3H3
InChIKeyUPESNHDERBIIFI-UHFFFAOYSA-N
MW295.45 g/mol
LogP2.30
Rot. Bonds7

About 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one

3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83254460) has the molecular formula C15H25N3OS and a molecular weight of 295.45 g/mol. Its IUPAC name is 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83254460
Molecular FormulaC15H25N3OS
Molecular Weight295.45 g/mol
Exact Mass295.17
IUPAC Name3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCC1NC(c2ccsc2)N(CCN(C)CC)C1=O
InChIInChI=1S/C15H25N3OS/c1-4-6-13-15(19)18(9-8-17(3)5-2)14(16-13)12-7-10-20-11-12/h7,10-11,13-14,16H,4-6,8-9H2,1-3H3
InChIKeyUPESNHDERBIIFI-UHFFFAOYSA-N
XLogP2.30
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one (CID 83254460) is 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one is CCCC1NC(c2ccsc2)N(CCN(C)CC)C1=O.
What is the InChIKey of 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is UPESNHDERBIIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3OS/c1-4-6-13-15(19)18(9-8-17(3)5-2)14(16-13)12-7-10-20-11-12/h7,10-11,13-14,16H,4-6,8-9H2,1-3H3.
What are the key properties of 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one?
3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 295.45 g/mol, XLogP of 2.30, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[ethyl(methyl)amino]ethyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83254460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).