5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one

C15H22N2OS — CID 83242881

IUPAC5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCCCCC1NC(c2ccc(C)s2)N(C2CC2)C1=O
InChIInChI=1S/C15H22N2OS/c1-3-4-5-12-15(18)17(11-7-8-11)14(16-12)13-9-6-10(2)19-13/h6,9,11-12,14,16H,3-5,7-8H2,1-2H3
InChIKeyRGMPEZMADMFWFS-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.21
Rot. Bonds5

About 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one

5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one (PubChem CID 83242881) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
PubChem CID83242881
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Name5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCCCCC1NC(c2ccc(C)s2)N(C2CC2)C1=O
InChIInChI=1S/C15H22N2OS/c1-3-4-5-12-15(18)17(11-7-8-11)14(16-12)13-9-6-10(2)19-13/h6,9,11-12,14,16H,3-5,7-8H2,1-2H3
InChIKeyRGMPEZMADMFWFS-UHFFFAOYSA-N
XLogP3.21
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.21
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-2-(5-methylthiophen-2-yl)-3-pentan-3-ylimidazolidin-4-one
CID 83245916
3-(2-methylcyclopentyl)-2-(5-methylthiophen-2-yl)-5-propylimidazolidin-4-one
CID 83264047
5-butyl-3-(3-methylcyclopentyl)-2-thiophen-2-ylimidazolidin-4-one
CID 114552342
5-butyl-3-cyclopropyl-2-(4-ethylphenyl)imidazolidin-4-one
CID 83244903
5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065521
5-butyl-2-(5-methylthiophen-2-yl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 83244694
5-butyl-3-cyclopropyl-2-(4-methylsulfanylphenyl)imidazolidin-4-one
CID 83244937
5-butyl-3-cyclopentyl-2-thiophen-3-ylimidazolidin-4-one
CID 83242915
3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243481
5-butyl-3-(oxolan-3-yl)-2-thiophen-2-ylimidazolidin-4-one
CID 83271009

Frequently Asked Questions

What is the IUPAC name of 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The IUPAC name of 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one (CID 83242881) is 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one.
What is the SMILES notation for 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The canonical SMILES for 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one is CCCCC1NC(c2ccc(C)s2)N(C2CC2)C1=O.
What is the InChIKey of 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The InChIKey is RGMPEZMADMFWFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-3-4-5-12-15(18)17(11-7-8-11)14(16-12)13-9-6-10(2)19-13/h6,9,11-12,14,16H,3-5,7-8H2,1-2H3.
What are the key properties of 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one has a molecular weight of 278.42 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83242881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).