2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one

C15H21FN2O — CID 83246051

IUPAC2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one
SMILESCCC(C)C(C)N1C(=O)CNC1c1ccc(F)cc1
InChIInChI=1S/C15H21FN2O/c1-4-10(2)11(3)18-14(19)9-17-15(18)12-5-7-13(16)8-6-12/h5-8,10-11,15,17H,4,9H2,1-3H3
InChIKeyMRKISNAXHCEFOE-UHFFFAOYSA-N
MW264.34 g/mol
LogP2.69
Rot. Bonds4

About 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one

2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one (PubChem CID 83246051) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one
PubChem CID83246051
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one
SMILESCCC(C)C(C)N1C(=O)CNC1c1ccc(F)cc1
InChIInChI=1S/C15H21FN2O/c1-4-10(2)11(3)18-14(19)9-17-15(18)12-5-7-13(16)8-6-12/h5-8,10-11,15,17H,4,9H2,1-3H3
InChIKeyMRKISNAXHCEFOE-UHFFFAOYSA-N
XLogP2.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,3-dimethylbutan-2-yl)-2-(4-fluorophenyl)imidazolidin-4-one
CID 114983582
2-(4-fluorophenyl)-3-(1-methoxypentan-2-yl)imidazolidin-4-one
CID 83263819
2-(4-chlorophenyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242920
3-pentan-3-yl-2-[4-(trifluoromethyl)phenyl]imidazolidin-4-one
CID 83246176
2-(4-fluorophenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
CID 83244287
2-(3-fluoro-4-methoxyphenyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242836
3-(3-ethylpentan-2-yl)-2-(3-methoxyphenyl)imidazolidin-4-one
CID 83262898
2-(2,4-difluorophenyl)-3-(3-methylbutan-2-yl)imidazolidin-4-one
CID 83250767
2-(4-ethoxyphenyl)-3-(1-methoxybutan-2-yl)imidazolidin-4-one
CID 83263485
3-(2,2-dimethylpropyl)-2-(4-fluorophenyl)imidazolidin-4-one
CID 83256551
2-(4-chlorophenyl)-3-[1-(diethylamino)propan-2-yl]imidazolidin-4-one
CID 83252428
2-(4-fluorophenyl)-3-(3-propoxypropyl)imidazolidin-4-one
CID 83260276

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one?
The IUPAC name of 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one (CID 83246051) is 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one.
What is the SMILES notation for 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one?
The canonical SMILES for 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one is CCC(C)C(C)N1C(=O)CNC1c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one?
The InChIKey is MRKISNAXHCEFOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-4-10(2)11(3)18-14(19)9-17-15(18)12-5-7-13(16)8-6-12/h5-8,10-11,15,17H,4,9H2,1-3H3.
What are the key properties of 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one?
2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one has a molecular weight of 264.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-(3-methylpentan-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83246051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).