2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one

C15H21ClN2O2 — CID 83242547

IUPAC2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one
SMILESCOCCN1C(=O)C(C(C)C)NC1c1ccc(Cl)cc1
InChIInChI=1S/C15H21ClN2O2/c1-10(2)13-15(19)18(8-9-20-3)14(17-13)11-4-6-12(16)7-5-11/h4-7,10,13-14,17H,8-9H2,1-3H3
InChIKeyRQJOZAXYYNMVJM-UHFFFAOYSA-N
MW296.80 g/mol
LogP2.44
Rot. Bonds5

About 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one

2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one (PubChem CID 83242547) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one
PubChem CID83242547
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one
SMILESCOCCN1C(=O)C(C(C)C)NC1c1ccc(Cl)cc1
InChIInChI=1S/C15H21ClN2O2/c1-10(2)13-15(19)18(8-9-20-3)14(17-13)11-4-6-12(16)7-5-11/h4-7,10,13-14,17H,8-9H2,1-3H3
InChIKeyRQJOZAXYYNMVJM-UHFFFAOYSA-N
XLogP2.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one (CID 83242547) is 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one is COCCN1C(=O)C(C(C)C)NC1c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one?
The InChIKey is RQJOZAXYYNMVJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c1-10(2)13-15(19)18(8-9-20-3)14(17-13)11-4-6-12(16)7-5-11/h4-7,10,13-14,17H,8-9H2,1-3H3.
What are the key properties of 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one?
2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one has a molecular weight of 296.80 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-(2-methoxyethyl)-5-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83242547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).