5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one

C14H22N2OS — CID 83240083

IUPAC5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCC(C)N1C(=O)C(CC)NC1c1ccsc1
InChIInChI=1S/C14H22N2OS/c1-4-6-10(3)16-13(11-7-8-18-9-11)15-12(5-2)14(16)17/h7-10,12-13,15H,4-6H2,1-3H3
InChIKeyYVFCKYFKSHYRAU-UHFFFAOYSA-N
MW266.41 g/mol
LogP3.15
Rot. Bonds5

About 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one

5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83240083) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83240083
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one
SMILESCCCC(C)N1C(=O)C(CC)NC1c1ccsc1
InChIInChI=1S/C14H22N2OS/c1-4-6-10(3)16-13(11-7-8-18-9-11)15-12(5-2)14(16)17/h7-10,12-13,15H,4-6H2,1-3H3
InChIKeyYVFCKYFKSHYRAU-UHFFFAOYSA-N
XLogP3.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-3-hexan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83252367
5-ethyl-3-(1-methylsulfonylpropan-2-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83263809
5-ethyl-3-(3-methylpentan-2-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83248366
3-[4-(dimethylamino)butan-2-yl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83253318
3-hexan-2-yl-5-propan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83252691
5-butyl-3-hexan-3-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83251878
5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242612
5-butyl-3-pentan-3-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83243016
5-butyl-3-(3,3-dimethylbutan-2-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 104830760
5-ethyl-3-hexan-2-yl-2-(4-methylphenyl)imidazolidin-4-one
CID 83252512
3-pentan-2-yl-2-phenyl-5-propylimidazolidin-4-one
CID 83239646
5-ethyl-3-(5-methylhexan-2-yl)-2-phenylimidazolidin-4-one
CID 83263251

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one (CID 83240083) is 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one is CCCC(C)N1C(=O)C(CC)NC1c1ccsc1.
What is the InChIKey of 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is YVFCKYFKSHYRAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-4-6-10(3)16-13(11-7-8-18-9-11)15-12(5-2)14(16)17/h7-10,12-13,15H,4-6H2,1-3H3.
What are the key properties of 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one?
5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 266.41 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83240083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).