2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one

C13H25N3O — CID 83248889

IUPAC2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one
SMILESCC1NC(C)N(CC(C)N2CCCCC2)C1=O
InChIInChI=1S/C13H25N3O/c1-10(15-7-5-4-6-8-15)9-16-12(3)14-11(2)13(16)17/h10-12,14H,4-9H2,1-3H3
InChIKeyUFBVIQPGAHPFBJ-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.03
Rot. Bonds3

About 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one

2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one (PubChem CID 83248889) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one
PubChem CID83248889
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one
SMILESCC1NC(C)N(CC(C)N2CCCCC2)C1=O
InChIInChI=1S/C13H25N3O/c1-10(15-7-5-4-6-8-15)9-16-12(3)14-11(2)13(16)17/h10-12,14H,4-9H2,1-3H3
InChIKeyUFBVIQPGAHPFBJ-UHFFFAOYSA-N
XLogP1.03
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-di(propan-2-yl)-3-(2-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83270705
2,5-dimethyl-3-(1-pyrrolidin-1-ylpropan-2-yl)imidazolidin-4-one
CID 83249326
3-(2-piperidin-1-ylpropyl)-2,5-dipropylimidazolidin-4-one
CID 83253294
2-ethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one
CID 83249426
5-butyl-2-ethyl-3-(2-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83270228
2-ethyl-3-(2-piperidin-1-ylpropyl)-1,3-diazaspiro[4.4]nonan-4-one
CID 83253291
2,4-dimethyl-6-oxo-1-(2-piperidin-1-ylpropyl)piperidine-3-carboxylic acid
CID 62302255
3-[2-[di(propan-2-yl)amino]ethyl]-2,5-dimethylimidazolidin-4-one
CID 83236812
3-(2,2-dimethylpropyl)-2,5-dimethylimidazolidin-4-one
CID 83256720
1-[1-(azacyclotetradec-1-yl)propan-2-yl]-azacyclotetradecane
CID 69225763
5-(2-methylpropyl)-6-(2-pyrrolidin-1-ylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83270788
2,5-dimethyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 83250601

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one?
The IUPAC name of 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one (CID 83248889) is 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one.
What is the SMILES notation for 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one?
The canonical SMILES for 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one is CC1NC(C)N(CC(C)N2CCCCC2)C1=O.
What is the InChIKey of 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one?
The InChIKey is UFBVIQPGAHPFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-10(15-7-5-4-6-8-15)9-16-12(3)14-11(2)13(16)17/h10-12,14H,4-9H2,1-3H3.
What are the key properties of 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one?
2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one has a molecular weight of 239.36 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-(2-piperidin-1-ylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83248889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).