3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one

C14H20FN3O — CID 83250403

IUPAC3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
SMILESCC1NC(c2ccc(F)cc2)N(CCN(C)C)C1=O
InChIInChI=1S/C14H20FN3O/c1-10-14(19)18(9-8-17(2)3)13(16-10)11-4-6-12(15)7-5-11/h4-7,10,13,16H,8-9H2,1-3H3
InChIKeyHAOOISHDZIQOSV-UHFFFAOYSA-N
MW265.33 g/mol
LogP1.21
Rot. Bonds4

About 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one

3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one (PubChem CID 83250403) has the molecular formula C14H20FN3O and a molecular weight of 265.33 g/mol. Its IUPAC name is 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
PubChem CID83250403
Molecular FormulaC14H20FN3O
Molecular Weight265.33 g/mol
Exact Mass265.16
IUPAC Name3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
SMILESCC1NC(c2ccc(F)cc2)N(CCN(C)C)C1=O
InChIInChI=1S/C14H20FN3O/c1-10-14(19)18(9-8-17(2)3)13(16-10)11-4-6-12(15)7-5-11/h4-7,10,13,16H,8-9H2,1-3H3
InChIKeyHAOOISHDZIQOSV-UHFFFAOYSA-N
XLogP1.21
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
The IUPAC name of 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one (CID 83250403) is 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one.
What is the SMILES notation for 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
The canonical SMILES for 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one is CC1NC(c2ccc(F)cc2)N(CCN(C)C)C1=O.
What is the InChIKey of 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
The InChIKey is HAOOISHDZIQOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FN3O/c1-10-14(19)18(9-8-17(2)3)13(16-10)11-4-6-12(15)7-5-11/h4-7,10,13,16H,8-9H2,1-3H3.
What are the key properties of 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one?
3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one has a molecular weight of 265.33 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(dimethylamino)ethyl]-2-(4-fluorophenyl)-5-methylimidazolidin-4-one is sourced from PubChem (CID 83250403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).