1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one

C13H18ClN3O — CID 23728

IUPAC1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one
SMILESCN(C)CCN1CCN(c2cccc(Cl)c2)C1=O
InChIInChI=1S/C13H18ClN3O/c1-15(2)6-7-16-8-9-17(13(16)18)12-5-3-4-11(14)10-12/h3-5,10H,6-9H2,1-2H3
InChIKeyKACVTTZEMNWITH-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.14
Rot. Bonds4

About 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one

1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one (PubChem CID 23728) has the molecular formula C13H18ClN3O and a molecular weight of 267.76 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one
PubChem CID23728
Molecular FormulaC13H18ClN3O
Molecular Weight267.76 g/mol
Exact Mass267.11
IUPAC Name1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one
SMILESCN(C)CCN1CCN(c2cccc(Cl)c2)C1=O
InChIInChI=1S/C13H18ClN3O/c1-15(2)6-7-16-8-9-17(13(16)18)12-5-3-4-11(14)10-12/h3-5,10H,6-9H2,1-2H3
InChIKeyKACVTTZEMNWITH-UHFFFAOYSA-N
XLogP2.14
TPSA26.79 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-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 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one?
The IUPAC name of 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one (CID 23728) is 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one.
What is the SMILES notation for 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one?
The canonical SMILES for 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one is CN(C)CCN1CCN(c2cccc(Cl)c2)C1=O.
What is the InChIKey of 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one?
The InChIKey is KACVTTZEMNWITH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClN3O/c1-15(2)6-7-16-8-9-17(13(16)18)12-5-3-4-11(14)10-12/h3-5,10H,6-9H2,1-2H3.
What are the key properties of 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one?
1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one has a molecular weight of 267.76 g/mol, XLogP of 2.14, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-[2-(dimethylamino)ethyl]imidazolidin-2-one is sourced from PubChem (CID 23728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).