3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one

C16H31N3O — CID 83244837

IUPAC3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(CCN2CCCCC2)C1=O
InChIInChI=1S/C16H31N3O/c1-3-8-14-16(20)19(15(17-14)9-4-2)13-12-18-10-6-5-7-11-18/h14-15,17H,3-13H2,1-2H3
InChIKeyWBLUGVVINGHUNZ-UHFFFAOYSA-N
MW281.44 g/mol
LogP2.20
Rot. Bonds7

About 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one

3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one (PubChem CID 83244837) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one
PubChem CID83244837
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one
SMILESCCCC1NC(CCC)N(CCN2CCCCC2)C1=O
InChIInChI=1S/C16H31N3O/c1-3-8-14-16(20)19(15(17-14)9-4-2)13-12-18-10-6-5-7-11-18/h14-15,17H,3-13H2,1-2H3
InChIKeyWBLUGVVINGHUNZ-UHFFFAOYSA-N
XLogP2.20
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpropyl)-5-propyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83249859
5-butyl-2-ethyl-3-(3-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83254451
3-pentyl-2,5-dipropylimidazolidin-4-one
CID 83250379
3-(2-piperidin-1-ylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83253294
3-(2-cyclopentyloxyethyl)-2,5-dipropylimidazolidin-4-one
CID 83257422
2,5-diethyl-3-(2-morpholin-4-ylethyl)imidazolidin-4-one
CID 83250866
5-methyl-2-propyl-3-(2-thiomorpholin-4-ylethyl)imidazolidin-4-one
CID 106327052
5-butyl-3-(3-cyclopentylpropyl)-2-propylimidazolidin-4-one
CID 106011295
3-(2-methylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83242304
5-ethyl-5-methyl-2-propyl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
CID 83252241
3-[(2-methylcyclopentyl)methyl]-2,5-dipropylimidazolidin-4-one
CID 107421422
2-(2-methylpropyl)-3,5-dipropylimidazolidin-4-one
CID 83242530

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one?
The IUPAC name of 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one (CID 83244837) is 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one.
What is the SMILES notation for 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one?
The canonical SMILES for 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one is CCCC1NC(CCC)N(CCN2CCCCC2)C1=O.
What is the InChIKey of 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one?
The InChIKey is WBLUGVVINGHUNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-3-8-14-16(20)19(15(17-14)9-4-2)13-12-18-10-6-5-7-11-18/h14-15,17H,3-13H2,1-2H3.
What are the key properties of 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one?
3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one has a molecular weight of 281.44 g/mol, XLogP of 2.20, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperidin-1-ylethyl)-2,5-dipropylimidazolidin-4-one is sourced from PubChem (CID 83244837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).