1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one

C24H23FN2O2 — CID 67104748

IUPAC1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one
SMILESO=C1CC(CCO)(c2ccccc2)CCN1c1cccc(-c2ccc(F)cc2)n1
InChIInChI=1S/C24H23FN2O2/c25-20-11-9-18(10-12-20)21-7-4-8-22(26-21)27-15-13-24(14-16-28,17-23(27)29)19-5-2-1-3-6-19/h1-12,28H,13-17H2
InChIKeyAWHAEJLGCNKXIT-UHFFFAOYSA-N
MW390.46 g/mol
LogP4.33
Rot. Bonds5

About 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one

1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one (PubChem CID 67104748) has the molecular formula C24H23FN2O2 and a molecular weight of 390.46 g/mol. Its IUPAC name is 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one.

Molecular Properties

Compound Name1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one
PubChem CID67104748
Molecular FormulaC24H23FN2O2
Molecular Weight390.46 g/mol
Exact Mass390.17
IUPAC Name1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one
SMILESO=C1CC(CCO)(c2ccccc2)CCN1c1cccc(-c2ccc(F)cc2)n1
InChIInChI=1S/C24H23FN2O2/c25-20-11-9-18(10-12-20)21-7-4-8-22(26-21)27-15-13-24(14-16-28,17-23(27)29)19-5-2-1-3-6-19/h1-12,28H,13-17H2
InChIKeyAWHAEJLGCNKXIT-UHFFFAOYSA-N
XLogP4.33
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one?
The IUPAC name of 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one (CID 67104748) is 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one.
What is the SMILES notation for 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one?
The canonical SMILES for 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one is O=C1CC(CCO)(c2ccccc2)CCN1c1cccc(-c2ccc(F)cc2)n1.
What is the InChIKey of 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one?
The InChIKey is AWHAEJLGCNKXIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN2O2/c25-20-11-9-18(10-12-20)21-7-4-8-22(26-21)27-15-13-24(14-16-28,17-23(27)29)19-5-2-1-3-6-19/h1-12,28H,13-17H2.
What are the key properties of 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one?
1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one has a molecular weight of 390.46 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-fluorophenyl)-2-pyridinyl]-4-(2-hydroxyethyl)-4-phenylpiperidin-2-one is sourced from PubChem (CID 67104748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).