1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one

C14H18FN3O — CID 68820432

IUPAC1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H18FN3O/c15-11-1-3-12(4-2-11)17-8-5-13(6-9-17)18-10-7-16-14(18)19/h1-4,13H,5-10H2,(H,16,19)
InChIKeyXWEQYXNHJFRETO-UHFFFAOYSA-N
MW263.32 g/mol
LogP1.82
Rot. Bonds2

About 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one

1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one (PubChem CID 68820432) has the molecular formula C14H18FN3O and a molecular weight of 263.32 g/mol. Its IUPAC name is 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one.

Molecular Properties

Compound Name1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one
PubChem CID68820432
Molecular FormulaC14H18FN3O
Molecular Weight263.32 g/mol
Exact Mass263.14
IUPAC Name1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one
SMILESO=C1NCCN1C1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H18FN3O/c15-11-1-3-12(4-2-11)17-8-5-13(6-9-17)18-10-7-16-14(18)19/h1-4,13H,5-10H2,(H,16,19)
InChIKeyXWEQYXNHJFRETO-UHFFFAOYSA-N
XLogP1.82
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one?
The IUPAC name of 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one (CID 68820432) is 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one.
What is the SMILES notation for 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one?
The canonical SMILES for 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one is O=C1NCCN1C1CCN(c2ccc(F)cc2)CC1.
What is the InChIKey of 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one?
The InChIKey is XWEQYXNHJFRETO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN3O/c15-11-1-3-12(4-2-11)17-8-5-13(6-9-17)18-10-7-16-14(18)19/h1-4,13H,5-10H2,(H,16,19).
What are the key properties of 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one?
1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one has a molecular weight of 263.32 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-fluorophenyl)piperidin-4-yl]imidazolidin-2-one is sourced from PubChem (CID 68820432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).