5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one

C16H31N3O — CID 83250489

IUPAC5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one
SMILESCCC(C)C1NC(C2CCCC2)N(CCN(C)C)C1=O
InChIInChI=1S/C16H31N3O/c1-5-12(2)14-16(20)19(11-10-18(3)4)15(17-14)13-8-6-7-9-13/h12-15,17H,5-11H2,1-4H3
InChIKeyHNHWSUPELAMZEA-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.91
Rot. Bonds6

About 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one

5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one (PubChem CID 83250489) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one
PubChem CID83250489
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one
SMILESCCC(C)C1NC(C2CCCC2)N(CCN(C)C)C1=O
InChIInChI=1S/C16H31N3O/c1-5-12(2)14-16(20)19(11-10-18(3)4)15(17-14)13-8-6-7-9-13/h12-15,17H,5-11H2,1-4H3
InChIKeyHNHWSUPELAMZEA-UHFFFAOYSA-N
XLogP1.91
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butan-2-yl-3-[2-(dimethylamino)ethyl]-2-propylimidazolidin-4-one
CID 83250833
5-butan-2-yl-2-cyclopentyl-3-(oxolan-3-ylmethyl)imidazolidin-4-one
CID 83252729
2-cyclopentyl-3-(3-methylbutyl)-5-propan-2-ylimidazolidin-4-one
CID 83238286
2-cyclopentyl-3-(5-methylhexyl)-5-propan-2-ylimidazolidin-4-one
CID 83269160
5-butan-2-yl-3-[2-(diethylamino)ethyl]-2-methylimidazolidin-4-one
CID 83239751
2-cyclopentyl-3-(3-ethylpentan-2-yl)-5-propan-2-ylimidazolidin-4-one
CID 83262884
2-cyclopentyl-5-ethyl-3-[3-[methyl(propan-2-yl)amino]propyl]imidazolidin-4-one
CID 106053010
5-butan-2-yl-3-[2-[methyl(propan-2-yl)amino]ethyl]-2-propylimidazolidin-4-one
CID 83253763
3-butan-2-yl-1-[3-(dimethylamino)propyl]-6-ethylpiperazine-2,5-dione
CID 64960213
2-cyclopentyl-3-(2,3-dimethylbutyl)-5-propan-2-ylimidazolidin-4-one
CID 83258644
3-(cyclohexylmethyl)-2-cyclopentyl-5-propan-2-ylimidazolidin-4-one
CID 83247815
2-cyclopentyl-3-(2,2-difluoroethyl)-5-propan-2-ylimidazolidin-4-one
CID 83271372

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one (CID 83250489) is 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one is CCC(C)C1NC(C2CCCC2)N(CCN(C)C)C1=O.
What is the InChIKey of 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one?
The InChIKey is HNHWSUPELAMZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-5-12(2)14-16(20)19(11-10-18(3)4)15(17-14)13-8-6-7-9-13/h12-15,17H,5-11H2,1-4H3.
What are the key properties of 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one?
5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one has a molecular weight of 281.44 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-2-cyclopentyl-3-[2-(dimethylamino)ethyl]imidazolidin-4-one is sourced from PubChem (CID 83250489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).