3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one

C15H23N3O — CID 83251335

IUPAC3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one
SMILESCc1ccc(C2NCC(=O)N2CCN(C)C)c(C)c1
InChIInChI=1S/C15H23N3O/c1-11-5-6-13(12(2)9-11)15-16-10-14(19)18(15)8-7-17(3)4/h5-6,9,15-16H,7-8,10H2,1-4H3
InChIKeyLDJWCATZSSHBDT-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.30
Rot. Bonds4

About 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one

3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one (PubChem CID 83251335) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one
PubChem CID83251335
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one
SMILESCc1ccc(C2NCC(=O)N2CCN(C)C)c(C)c1
InChIInChI=1S/C15H23N3O/c1-11-5-6-13(12(2)9-11)15-16-10-14(19)18(15)8-7-17(3)4/h5-6,9,15-16H,7-8,10H2,1-4H3
InChIKeyLDJWCATZSSHBDT-UHFFFAOYSA-N
XLogP1.30
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-cyclopentylethyl)-2-(2,4-dimethylphenyl)imidazolidin-4-one
CID 83246005
3-[2-(dimethylamino)propyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one
CID 83249995
methyl 3-[2-(2,4-dimethylphenyl)-5-oxoimidazolidin-1-yl]propanoate
CID 83255760
6-[2-(dimethylamino)ethyl]-5-(2,4-dimethylphenyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83248007
3-(2-butoxyethyl)-2-(2,4-dimethylphenyl)imidazolidin-4-one
CID 83252968
2-(2,4-dimethylphenyl)-3-[(1-methylpyrrolidin-3-yl)methyl]imidazolidin-4-one
CID 83245513
2-(2,5-dimethylphenyl)-3-propylimidazolidin-4-one
CID 115282074
2-(2,4-dimethylphenyl)-3-[(4-methylthiophen-3-yl)methyl]imidazolidin-4-one
CID 83267679
2-(2,5-dimethylphenyl)-3-ethylimidazolidin-4-one
CID 115282036
3-[2-(dimethylamino)ethyl]-2-(4-propan-2-ylphenyl)imidazolidin-4-one
CID 83251685
3-[2-(dimethylamino)propyl]-2-(2,5-dimethylphenyl)imidazolidin-4-one
CID 83249885
3-[2-(dimethylamino)ethyl]-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one
CID 83248240

Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one?
The IUPAC name of 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one (CID 83251335) is 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one.
What is the SMILES notation for 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one?
The canonical SMILES for 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one is Cc1ccc(C2NCC(=O)N2CCN(C)C)c(C)c1.
What is the InChIKey of 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one?
The InChIKey is LDJWCATZSSHBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-5-6-13(12(2)9-11)15-16-10-14(19)18(15)8-7-17(3)4/h5-6,9,15-16H,7-8,10H2,1-4H3.
What are the key properties of 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one?
3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one has a molecular weight of 261.37 g/mol, XLogP of 1.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)imidazolidin-4-one is sourced from PubChem (CID 83251335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).