2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one

C14H27N3O — CID 114517098

IUPAC2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one
SMILESCCC1NC(C)C(=O)N1CCC1CCN(C)CC1
InChIInChI=1S/C14H27N3O/c1-4-13-15-11(2)14(18)17(13)10-7-12-5-8-16(3)9-6-12/h11-13,15H,4-10H2,1-3H3
InChIKeyOPDDQWYRZHNQLU-UHFFFAOYSA-N
MW253.39 g/mol
LogP1.27
Rot. Bonds4

About 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one

2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one (PubChem CID 114517098) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one.

Molecular Properties

Compound Name2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one
PubChem CID114517098
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC Name2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one
SMILESCCC1NC(C)C(=O)N1CCC1CCN(C)CC1
InChIInChI=1S/C14H27N3O/c1-4-13-15-11(2)14(18)17(13)10-7-12-5-8-16(3)9-6-12/h11-13,15H,4-10H2,1-3H3
InChIKeyOPDDQWYRZHNQLU-UHFFFAOYSA-N
XLogP1.27
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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

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Related Compounds

5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]-2-propylimidazolidin-4-one
CID 114517126
5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]-2-thiophen-3-ylimidazolidin-4-one
CID 114517110
2-ethyl-3-[2-(4-methylcyclohexyl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83263281
3-(2-ethoxyethyl)-2-ethyl-5-methylimidazolidin-4-one
CID 83237257
2-ethyl-5-methyl-3-(2-methylsulfanylethyl)imidazolidin-4-one
CID 83257121
2-ethyl-5-methyl-3-(oxan-4-ylmethyl)imidazolidin-4-one
CID 83257022
3-[(1,1-dioxothiolan-3-yl)methyl]-2-ethyl-5-methylimidazolidin-4-one
CID 83251863
2-ethyl-3-[2-(4-methylcyclohexyl)ethyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83262817
5-methyl-2,3-dipropylimidazolidin-4-one
CID 83242080
3-cyclopropyl-2-ethyl-5-methylimidazolidin-4-one
CID 83242202
5-ethyl-6-[(1-methylpiperidin-4-yl)methyl]-4,6-diazaspiro[2.4]heptan-7-one
CID 83249122
5-methyl-2-propyl-3-(2-thiomorpholin-4-ylethyl)imidazolidin-4-one
CID 106327052

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one?
The IUPAC name of 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one (CID 114517098) is 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one.
What is the SMILES notation for 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one?
The canonical SMILES for 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one is CCC1NC(C)C(=O)N1CCC1CCN(C)CC1.
What is the InChIKey of 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one?
The InChIKey is OPDDQWYRZHNQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-4-13-15-11(2)14(18)17(13)10-7-12-5-8-16(3)9-6-12/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one?
2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one has a molecular weight of 253.39 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-3-[2-(1-methylpiperidin-4-yl)ethyl]imidazolidin-4-one is sourced from PubChem (CID 114517098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).