3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one

C15H19FN2O — CID 83247124

IUPAC3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
SMILESCC1NC(c2ccc(F)cc2)N(C2CC2(C)C)C1=O
InChIInChI=1S/C15H19FN2O/c1-9-14(19)18(12-8-15(12,2)3)13(17-9)10-4-6-11(16)7-5-10/h4-7,9,12-13,17H,8H2,1-3H3
InChIKeyRCGSAWXJVGUUAG-UHFFFAOYSA-N
MW262.33 g/mol
LogP2.44
Rot. Bonds2

About 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one

3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one (PubChem CID 83247124) has the molecular formula C15H19FN2O and a molecular weight of 262.33 g/mol. Its IUPAC name is 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
PubChem CID83247124
Molecular FormulaC15H19FN2O
Molecular Weight262.33 g/mol
Exact Mass262.15
IUPAC Name3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
SMILESCC1NC(c2ccc(F)cc2)N(C2CC2(C)C)C1=O
InChIInChI=1S/C15H19FN2O/c1-9-14(19)18(12-8-15(12,2)3)13(17-9)10-4-6-11(16)7-5-10/h4-7,9,12-13,17H,8H2,1-3H3
InChIKeyRCGSAWXJVGUUAG-UHFFFAOYSA-N
XLogP2.44
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83241955
3-(2,2-dimethylcyclopropyl)-5-ethyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83247393
3-cyclopentyl-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83243189
2-(4-fluorophenyl)-5-methyl-3-propylimidazolidin-4-one
CID 115282121
3-cyclopropyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
CID 83242288
2-(4-chlorophenyl)-3-cyclobutyl-5-methylimidazolidin-4-one
CID 83254897
5-butan-2-yl-3-(2,2-dimethylcyclopropyl)-2-phenylimidazolidin-4-one
CID 83245806
3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83247388
3-cyclobutyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
CID 83254892
3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83250403
3-cyclopentyl-5-ethyl-2-(4-fluorophenyl)imidazolidin-4-one
CID 83242494
5-methyl-3-(3-methylcyclopentyl)-2-(4-methylphenyl)imidazolidin-4-one
CID 114552392

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
The IUPAC name of 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one (CID 83247124) is 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one.
What is the SMILES notation for 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
The canonical SMILES for 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one is CC1NC(c2ccc(F)cc2)N(C2CC2(C)C)C1=O.
What is the InChIKey of 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
The InChIKey is RCGSAWXJVGUUAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19FN2O/c1-9-14(19)18(12-8-15(12,2)3)13(17-9)10-4-6-11(16)7-5-10/h4-7,9,12-13,17H,8H2,1-3H3.
What are the key properties of 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one has a molecular weight of 262.33 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one is sourced from PubChem (CID 83247124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).