2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one

C14H19ClN2O2 — CID 83248863

IUPAC2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
SMILESCOCC(C)CN1C(=O)CNC1c1cccc(Cl)c1
InChIInChI=1S/C14H19ClN2O2/c1-10(9-19-2)8-17-13(18)7-16-14(17)11-4-3-5-12(15)6-11/h3-6,10,14,16H,7-9H2,1-2H3
InChIKeyVQILEDFBJWTHFC-UHFFFAOYSA-N
MW282.77 g/mol
LogP2.05
Rot. Bonds5

About 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one

2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one (PubChem CID 83248863) has the molecular formula C14H19ClN2O2 and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
PubChem CID83248863
Molecular FormulaC14H19ClN2O2
Molecular Weight282.77 g/mol
Exact Mass282.11
IUPAC Name2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
SMILESCOCC(C)CN1C(=O)CNC1c1cccc(Cl)c1
InChIInChI=1S/C14H19ClN2O2/c1-10(9-19-2)8-17-13(18)7-16-14(17)11-4-3-5-12(15)6-11/h3-6,10,14,16H,7-9H2,1-2H3
InChIKeyVQILEDFBJWTHFC-UHFFFAOYSA-N
XLogP2.05
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-difluorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
CID 83248778
3-(3-methoxy-2-methylpropyl)-2-(3-nitrophenyl)imidazolidin-4-one
CID 83252754
2-(3-chlorophenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one
CID 114983378
2-(4-chlorophenyl)-3-(2-methyl-3-methylsulfanylpropyl)imidazolidin-4-one
CID 83257632
3-butan-2-yl-2-(3-chlorophenyl)imidazolidin-4-one
CID 83239586
2-(3-chlorophenyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242756
2-(4-methoxy-3-methylphenyl)-3-(2-methylbutyl)imidazolidin-4-one
CID 83253955
3-[2-(dimethylamino)propyl]-2-(3-methoxyphenyl)imidazolidin-4-one
CID 83249778
3-(2-methoxyethyl)-2-(4-propan-2-ylphenyl)imidazolidin-4-one
CID 115282239
2-(3-chlorophenyl)-3-(dicyclopropylmethyl)imidazolidin-4-one
CID 83253191
2-(3-chlorophenyl)-3-(2-methoxycyclopentyl)imidazolidin-4-one
CID 83252529
2-(3-chlorophenyl)-3-[(4-methylmorpholin-2-yl)methyl]imidazolidin-4-one
CID 83268879

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one (CID 83248863) is 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one is COCC(C)CN1C(=O)CNC1c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one?
The InChIKey is VQILEDFBJWTHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2/c1-10(9-19-2)8-17-13(18)7-16-14(17)11-4-3-5-12(15)6-11/h3-6,10,14,16H,7-9H2,1-2H3.
What are the key properties of 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one?
2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one has a molecular weight of 282.77 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83248863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).