2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one

C14H19ClN2O — CID 83240043

IUPAC2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one
SMILESCCCC1NC(c2cccc(Cl)c2)N(CC)C1=O
InChIInChI=1S/C14H19ClN2O/c1-3-6-12-14(18)17(4-2)13(16-12)10-7-5-8-11(15)9-10/h5,7-9,12-13,16H,3-4,6H2,1-2H3
InChIKeyJVYIOZMTNQBUOI-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.96
Rot. Bonds4

About 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one

2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one (PubChem CID 83240043) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one
PubChem CID83240043
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one
SMILESCCCC1NC(c2cccc(Cl)c2)N(CC)C1=O
InChIInChI=1S/C14H19ClN2O/c1-3-6-12-14(18)17(4-2)13(16-12)10-7-5-8-11(15)9-10/h5,7-9,12-13,16H,3-4,6H2,1-2H3
InChIKeyJVYIOZMTNQBUOI-UHFFFAOYSA-N
XLogP2.96
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-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

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one?
The IUPAC name of 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one (CID 83240043) is 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one.
What is the SMILES notation for 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one?
The canonical SMILES for 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one is CCCC1NC(c2cccc(Cl)c2)N(CC)C1=O.
What is the InChIKey of 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one?
The InChIKey is JVYIOZMTNQBUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c1-3-6-12-14(18)17(4-2)13(16-12)10-7-5-8-11(15)9-10/h5,7-9,12-13,16H,3-4,6H2,1-2H3.
What are the key properties of 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one?
2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one has a molecular weight of 266.77 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-3-ethyl-5-propylimidazolidin-4-one is sourced from PubChem (CID 83240043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).