5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one

C16H24N2OS — CID 83258168

IUPAC5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
SMILESCCC1NC(c2ccsc2)N(CC2(C)CCCC2)C1=O
InChIInChI=1S/C16H24N2OS/c1-3-13-15(19)18(11-16(2)7-4-5-8-16)14(17-13)12-6-9-20-10-12/h6,9-10,13-14,17H,3-5,7-8,11H2,1-2H3
InChIKeyOPQPCVADLCWNAX-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.54
Rot. Bonds4

About 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one

5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one (PubChem CID 83258168) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
PubChem CID83258168
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
SMILESCCC1NC(c2ccsc2)N(CC2(C)CCCC2)C1=O
InChIInChI=1S/C16H24N2OS/c1-3-13-15(19)18(11-16(2)7-4-5-8-16)14(17-13)12-6-9-20-10-12/h6,9-10,13-14,17H,3-5,7-8,11H2,1-2H3
InChIKeyOPQPCVADLCWNAX-UHFFFAOYSA-N
XLogP3.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-3-[(1-methylcyclobutyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114109735
5-ethyl-3-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242612
3-[(1,1-dioxothiolan-2-yl)methyl]-5-ethyl-2-thiophen-3-ylimidazolidin-4-one
CID 83266746
5-ethyl-3-[(1-ethylpyrrolidin-3-yl)methyl]-2-thiophen-3-ylimidazolidin-4-one
CID 83245993
3,5-dipropyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242253
3-(cyclobutylmethyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83243416
5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83240083
5-ethyl-3-(3-methylpentan-2-yl)-2-thiophen-3-ylimidazolidin-4-one
CID 83248366
3-[4-(dimethylamino)butyl]-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83245135
5-ethyl-3-hexan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83252367
3-(2-ethoxyethyl)-5-propyl-2-thiophen-3-ylimidazolidin-4-one
CID 83237977
5-butyl-3-(4-methoxybutyl)-2-thiophen-3-ylimidazolidin-4-one
CID 83248664

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one (CID 83258168) is 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one is CCC1NC(c2ccsc2)N(CC2(C)CCCC2)C1=O.
What is the InChIKey of 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one?
The InChIKey is OPQPCVADLCWNAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-3-13-15(19)18(11-16(2)7-4-5-8-16)14(17-13)12-6-9-20-10-12/h6,9-10,13-14,17H,3-5,7-8,11H2,1-2H3.
What are the key properties of 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one?
5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one is sourced from PubChem (CID 83258168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).