3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one

C15H22N2OS — CID 83264382

IUPAC3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCCC(CC1CC1)N1C(=O)CNC1c1ccc(C)s1
InChIInChI=1S/C15H22N2OS/c1-3-12(8-11-5-6-11)17-14(18)9-16-15(17)13-7-4-10(2)19-13/h4,7,11-12,15-16H,3,5-6,8-9H2,1-2H3
InChIKeyNZOAUKAYYNDNKM-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.07
Rot. Bonds5

About 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one

3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one (PubChem CID 83264382) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
PubChem CID83264382
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Name3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCCC(CC1CC1)N1C(=O)CNC1c1ccc(C)s1
InChIInChI=1S/C15H22N2OS/c1-3-12(8-11-5-6-11)17-14(18)9-16-15(17)13-7-4-10(2)19-13/h4,7,11-12,15-16H,3,5-6,8-9H2,1-2H3
InChIKeyNZOAUKAYYNDNKM-UHFFFAOYSA-N
XLogP3.07
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 ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-methoxybutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83259327
3-[2-(4-methylcyclohexyl)ethyl]-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83262823
3-(cyclohexylmethyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83244089
3-cyclopentyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243272
3-cyclobutyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83254899
5-methyl-2-(5-methylthiophen-2-yl)-3-pentan-3-ylimidazolidin-4-one
CID 83242674
2-(5-methylthiophen-2-yl)-3-octylimidazolidin-4-one
CID 83260835
3-[(1-ethylpyrrolidin-3-yl)methyl]-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83255799
2-(2,5-dimethylphenyl)-3-hexan-3-ylimidazolidin-4-one
CID 83252372
2-(5-methylthiophen-2-yl)-3-(thiolan-3-ylmethyl)imidazolidin-4-one
CID 107299016
2-(4-chlorophenyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242920
3-[3-[methyl(propan-2-yl)amino]propyl]-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 106053056

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The IUPAC name of 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one (CID 83264382) is 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one.
What is the SMILES notation for 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The canonical SMILES for 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one is CCC(CC1CC1)N1C(=O)CNC1c1ccc(C)s1.
What is the InChIKey of 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The InChIKey is NZOAUKAYYNDNKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-3-12(8-11-5-6-11)17-14(18)9-16-15(17)13-7-4-10(2)19-13/h4,7,11-12,15-16H,3,5-6,8-9H2,1-2H3.
What are the key properties of 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one has a molecular weight of 278.42 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylbutan-2-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83264382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).