3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one

C14H27N3O — CID 107165646

IUPAC3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one
SMILESCCC1NC(C)N(CC2(C)CCN(C)CC2)C1=O
InChIInChI=1S/C14H27N3O/c1-5-12-13(18)17(11(2)15-12)10-14(3)6-8-16(4)9-7-14/h11-12,15H,5-10H2,1-4H3
InChIKeyXHNNIXZNCCNSRI-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.27
Rot. Bonds3

About 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one

3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one (PubChem CID 107165646) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one
PubChem CID107165646
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one
SMILESCCC1NC(C)N(CC2(C)CCN(C)CC2)C1=O
InChIInChI=1S/C14H27N3O/c1-5-12-13(18)17(11(2)15-12)10-14(3)6-8-16(4)9-7-14/h11-12,15H,5-10H2,1-4H3
InChIKeyXHNNIXZNCCNSRI-UHFFFAOYSA-N
XLogP1.27
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(1,4-dimethylpiperidin-4-yl)methyl]-2,5-diethylimidazolidin-4-one
CID 107165674
3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-propan-2-ylimidazolidin-4-one
CID 107165629
1-[(1,4-dimethylpiperidin-4-yl)methyl]-3,6-diethylpiperazine-2,5-dione
CID 107165375
5-ethyl-2-methyl-3-[[1-(2-methylpropyl)cyclopentyl]methyl]imidazolidin-4-one
CID 83270482
5-ethyl-2-methyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83254703
5-ethyl-2-methyl-3-pentylimidazolidin-4-one
CID 83251398
3-[[1-(dimethylamino)cyclopentyl]methyl]-2-methyl-5-propylimidazolidin-4-one
CID 83260767
3-(3-ethoxypropyl)-5-ethyl-2-methylimidazolidin-4-one
CID 83237626
5-ethyl-2-methyl-3-(oxan-4-ylmethyl)imidazolidin-4-one
CID 83257443
5-ethyl-3-[(1-methylcyclopentyl)methyl]-2-thiophen-3-ylimidazolidin-4-one
CID 83258168
2-methyl-3-[(1-methylsulfanylcyclobutyl)methyl]-5-propylimidazolidin-4-one
CID 114117436
1-[(1,4-dimethylpiperidin-4-yl)methyl]-3-(methylamino)piperidin-2-one
CID 107165265

Frequently Asked Questions

What is the IUPAC name of 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one?
The IUPAC name of 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one (CID 107165646) is 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one.
What is the SMILES notation for 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one?
The canonical SMILES for 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one is CCC1NC(C)N(CC2(C)CCN(C)CC2)C1=O.
What is the InChIKey of 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one?
The InChIKey is XHNNIXZNCCNSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-5-12-13(18)17(11(2)15-12)10-14(3)6-8-16(4)9-7-14/h11-12,15H,5-10H2,1-4H3.
What are the key properties of 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one?
3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one has a molecular weight of 253.39 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1,4-dimethylpiperidin-4-yl)methyl]-5-ethyl-2-methylimidazolidin-4-one is sourced from PubChem (CID 107165646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).