2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one

C15H19ClN2O2 — CID 83256838

IUPAC2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one
SMILESCC1NC(c2ccc(Cl)cc2)N(C2CCOCC2)C1=O
InChIInChI=1S/C15H19ClN2O2/c1-10-15(19)18(13-6-8-20-9-7-13)14(17-10)11-2-4-12(16)5-3-11/h2-5,10,13-14,17H,6-9H2,1H3
InChIKeyUOICNZYYVZJSKF-UHFFFAOYSA-N
MW294.78 g/mol
LogP2.34
Rot. Bonds2

About 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one

2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one (PubChem CID 83256838) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one
PubChem CID83256838
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one
SMILESCC1NC(c2ccc(Cl)cc2)N(C2CCOCC2)C1=O
InChIInChI=1S/C15H19ClN2O2/c1-10-15(19)18(13-6-8-20-9-7-13)14(17-10)11-2-4-12(16)5-3-11/h2-5,10,13-14,17H,6-9H2,1H3
InChIKeyUOICNZYYVZJSKF-UHFFFAOYSA-N
XLogP2.34
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-3-cyclobutyl-5-methylimidazolidin-4-one
CID 83254897
5-methyl-2-(4-nitrophenyl)-3-(oxolan-3-yl)imidazolidin-4-one
CID 83267221
3-cyclopentyl-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83243189
3-cyclopentyl-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83241955
5-methyl-3-(oxolan-3-yl)-2-thiophen-2-ylimidazolidin-4-one
CID 83270215
2-(3-methoxyphenyl)-5-methyl-3-(oxolan-3-yl)imidazolidin-4-one
CID 83270932
2-(4-chlorophenyl)-3-(cyclopentylmethyl)-5-methylimidazolidin-4-one
CID 83244083
5-methyl-3-(3-methylcyclopentyl)-2-(4-methylphenyl)imidazolidin-4-one
CID 114552392
5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one
CID 83242460
2-(4-chlorophenyl)-3-[2-[cyclopropyl(methyl)amino]ethyl]-5-methylimidazolidin-4-one
CID 83248992
2-(2,5-dimethylphenyl)-5-methyl-3-(oxolan-3-yl)imidazolidin-4-one
CID 83270445
2-(3,4-difluorophenyl)-5-methyl-3-(1-methylpyrrolidin-3-yl)imidazolidin-4-one
CID 83252608

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one (CID 83256838) is 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one is CC1NC(c2ccc(Cl)cc2)N(C2CCOCC2)C1=O.
What is the InChIKey of 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one?
The InChIKey is UOICNZYYVZJSKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-10-15(19)18(13-6-8-20-9-7-13)14(17-10)11-2-4-12(16)5-3-11/h2-5,10,13-14,17H,6-9H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one?
2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one has a molecular weight of 294.78 g/mol, XLogP of 2.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one is sourced from PubChem (CID 83256838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).