3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one

C17H26N2OS — CID 83264047

IUPAC3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(c2ccc(C)s2)N(C2CCCC2C)C1=O
InChIInChI=1S/C17H26N2OS/c1-4-6-13-17(20)19(14-8-5-7-11(14)2)16(18-13)15-10-9-12(3)21-15/h9-11,13-14,16,18H,4-8H2,1-3H3
InChIKeyWUEOSIUPLJCRRN-UHFFFAOYSA-N
MW306.48 g/mol
LogP3.84
Rot. Bonds4

About 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one

3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one (PubChem CID 83264047) has the molecular formula C17H26N2OS and a molecular weight of 306.48 g/mol. Its IUPAC name is 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
PubChem CID83264047
Molecular FormulaC17H26N2OS
Molecular Weight306.48 g/mol
Exact Mass306.18
IUPAC Name3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(c2ccc(C)s2)N(C2CCCC2C)C1=O
InChIInChI=1S/C17H26N2OS/c1-4-6-13-17(20)19(14-8-5-7-11(14)2)16(18-13)15-10-9-12(3)21-15/h9-11,13-14,16,18H,4-8H2,1-3H3
InChIKeyWUEOSIUPLJCRRN-UHFFFAOYSA-N
XLogP3.84
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.48
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-methylthiophen-2-yl)-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83245482
3-(1-methylpyrrolidin-3-yl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83252605
5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83242881
2-ethyl-3-(2-methylcycloheptyl)-5-propylimidazolidin-4-one
CID 83258935
3-(3-methylpentan-2-yl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83247626
3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83254821
5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065521
5-butyl-2-(5-methylthiophen-2-yl)-3-pentan-3-ylimidazolidin-4-one
CID 83245916
3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243481
5-butyl-2-methyl-3-(2-methylcycloheptyl)imidazolidin-4-one
CID 83259175
3-(2-methyloxolan-3-yl)-5-propyl-2-thiophen-2-ylimidazolidin-4-one
CID 83260023
6-ethyl-1-(2-methylcyclohexyl)-3-propylpiperazine-2,5-dione
CID 64959124

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one?
The IUPAC name of 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one (CID 83264047) is 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one is CCCC1NC(c2ccc(C)s2)N(C2CCCC2C)C1=O.
What is the InChIKey of 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one?
The InChIKey is WUEOSIUPLJCRRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2OS/c1-4-6-13-17(20)19(14-8-5-7-11(14)2)16(18-13)15-10-9-12(3)21-15/h9-11,13-14,16,18H,4-8H2,1-3H3.
What are the key properties of 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one?
3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one has a molecular weight of 306.48 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83264047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).