1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one

C14H12FN3O — CID 82132304

IUPAC1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one
SMILESO=C1NCC(c2ccccn2)N1c1ccc(F)cc1
InChIInChI=1S/C14H12FN3O/c15-10-4-6-11(7-5-10)18-13(9-17-14(18)19)12-3-1-2-8-16-12/h1-8,13H,9H2,(H,17,19)
InChIKeyPHWWKGNAVUWAEQ-UHFFFAOYSA-N
MW257.27 g/mol
LogP2.49
Rot. Bonds2

About 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one

1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one (PubChem CID 82132304) has the molecular formula C14H12FN3O and a molecular weight of 257.27 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one
PubChem CID82132304
Molecular FormulaC14H12FN3O
Molecular Weight257.27 g/mol
Exact Mass257.10
IUPAC Name1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one
SMILESO=C1NCC(c2ccccn2)N1c1ccc(F)cc1
InChIInChI=1S/C14H12FN3O/c15-10-4-6-11(7-5-10)18-13(9-17-14(18)19)12-3-1-2-8-16-12/h1-8,13H,9H2,(H,17,19)
InChIKeyPHWWKGNAVUWAEQ-UHFFFAOYSA-N
XLogP2.49
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.27
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one?
The IUPAC name of 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one (CID 82132304) is 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one?
The canonical SMILES for 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one is O=C1NCC(c2ccccn2)N1c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one?
The InChIKey is PHWWKGNAVUWAEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3O/c15-10-4-6-11(7-5-10)18-13(9-17-14(18)19)12-3-1-2-8-16-12/h1-8,13H,9H2,(H,17,19).
What are the key properties of 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one?
1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one has a molecular weight of 257.27 g/mol, XLogP of 2.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-5-pyridin-2-ylimidazolidin-2-one is sourced from PubChem (CID 82132304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).