2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one

C15H21FN2O3 — CID 114983389

IUPAC2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2CC(C)(C)OC)cc1F
InChIInChI=1S/C15H21FN2O3/c1-15(2,21-4)9-18-13(19)8-17-14(18)10-5-6-12(20-3)11(16)7-10/h5-7,14,17H,8-9H2,1-4H3
InChIKeyRMJZYJULVJFMNL-UHFFFAOYSA-N
MW296.34 g/mol
LogP1.69
Rot. Bonds5

About 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one

2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one (PubChem CID 114983389) has the molecular formula C15H21FN2O3 and a molecular weight of 296.34 g/mol. Its IUPAC name is 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one
PubChem CID114983389
Molecular FormulaC15H21FN2O3
Molecular Weight296.34 g/mol
Exact Mass296.15
IUPAC Name2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2CC(C)(C)OC)cc1F
InChIInChI=1S/C15H21FN2O3/c1-15(2,21-4)9-18-13(19)8-17-14(18)10-5-6-12(20-3)11(16)7-10/h5-7,14,17H,8-9H2,1-4H3
InChIKeyRMJZYJULVJFMNL-UHFFFAOYSA-N
XLogP1.69
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-fluoro-4-methoxyphenyl)-3-(2-methylsulfonylethyl)imidazolidin-4-one
CID 83246302
2-(3-fluoro-4-methoxyphenyl)-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 114983330
2-(3-chlorophenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one
CID 114983378
2-(3-fluoro-4-methoxyphenyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242836
3-(2,2-dimethylpropyl)-2-(4-fluorophenyl)imidazolidin-4-one
CID 83256551
2-(3,4-difluorophenyl)-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
CID 83248778
2-(4-chlorophenyl)-3-(2,2-dimethylpropyl)imidazolidin-4-one
CID 83256713
2-(4-methoxy-3-methylphenyl)-3-(2-methylbutyl)imidazolidin-4-one
CID 83253955
3-(2,2-dimethylpropyl)-2-[3-(trifluoromethyl)phenyl]imidazolidin-4-one
CID 83247057
5-(3-fluoro-4-methoxyphenyl)-6-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83243214
5-(3-fluoro-4-methoxyphenyl)-6-(2-methoxyethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83247259
6-butyl-5-(3-fluoro-4-methoxyphenyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83237728

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one (CID 114983389) is 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one is COc1ccc(C2NCC(=O)N2CC(C)(C)OC)cc1F.
What is the InChIKey of 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one?
The InChIKey is RMJZYJULVJFMNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O3/c1-15(2,21-4)9-18-13(19)8-17-14(18)10-5-6-12(20-3)11(16)7-10/h5-7,14,17H,8-9H2,1-4H3.
What are the key properties of 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one?
2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one has a molecular weight of 296.34 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluoro-4-methoxyphenyl)-3-(2-methoxy-2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 114983389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).