4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one

C19H20FNO — CID 22603711

IUPAC4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one
SMILESCC(c1ccccc1)N1CCC(c2ccc(F)cc2)CC1=O
InChIInChI=1S/C19H20FNO/c1-14(15-5-3-2-4-6-15)21-12-11-17(13-19(21)22)16-7-9-18(20)10-8-16/h2-10,14,17H,11-13H2,1H3
InChIKeySPRHCKWEIXYVFV-UHFFFAOYSA-N
MW297.37 g/mol
LogP4.29
Rot. Bonds3

About 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one

4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one (PubChem CID 22603711) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one.

Molecular Properties

Compound Name4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one
PubChem CID22603711
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC Name4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one
SMILESCC(c1ccccc1)N1CCC(c2ccc(F)cc2)CC1=O
InChIInChI=1S/C19H20FNO/c1-14(15-5-3-2-4-6-15)21-12-11-17(13-19(21)22)16-7-9-18(20)10-8-16/h2-10,14,17H,11-13H2,1H3
InChIKeySPRHCKWEIXYVFV-UHFFFAOYSA-N
XLogP4.29
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one?
The IUPAC name of 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one (CID 22603711) is 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one.
What is the SMILES notation for 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one?
The canonical SMILES for 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one is CC(c1ccccc1)N1CCC(c2ccc(F)cc2)CC1=O.
What is the InChIKey of 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one?
The InChIKey is SPRHCKWEIXYVFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO/c1-14(15-5-3-2-4-6-15)21-12-11-17(13-19(21)22)16-7-9-18(20)10-8-16/h2-10,14,17H,11-13H2,1H3.
What are the key properties of 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one?
4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one has a molecular weight of 297.37 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-1-(1-phenylethyl)piperidin-2-one is sourced from PubChem (CID 22603711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).