(4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone

C18H18FNO — CID 2894533

IUPAC(4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(c2ccccc2)C1
InChIInChI=1S/C18H18FNO/c19-17-10-8-15(9-11-17)18(21)20-12-4-7-16(13-20)14-5-2-1-3-6-14/h1-3,5-6,8-11,16H,4,7,12-13H2
InChIKeyHGOXDUCHIOIWFR-UHFFFAOYSA-N
MW283.35 g/mol
LogP3.85
Rot. Bonds2

About (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone

(4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone (PubChem CID 2894533) has the molecular formula C18H18FNO and a molecular weight of 283.35 g/mol. Its IUPAC name is (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone
PubChem CID2894533
Molecular FormulaC18H18FNO
Molecular Weight283.35 g/mol
Exact Mass283.14
IUPAC Name(4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(c2ccccc2)C1
InChIInChI=1S/C18H18FNO/c19-17-10-8-15(9-11-17)18(21)20-12-4-7-16(13-20)14-5-2-1-3-6-14/h1-3,5-6,8-11,16H,4,7,12-13H2
InChIKeyHGOXDUCHIOIWFR-UHFFFAOYSA-N
XLogP3.85
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone?
The IUPAC name of (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone (CID 2894533) is (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone?
The canonical SMILES for (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone is O=C(c1ccc(F)cc1)N1CCCC(c2ccccc2)C1.
What is the InChIKey of (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone?
The InChIKey is HGOXDUCHIOIWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO/c19-17-10-8-15(9-11-17)18(21)20-12-4-7-16(13-20)14-5-2-1-3-6-14/h1-3,5-6,8-11,16H,4,7,12-13H2.
What are the key properties of (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone?
(4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone has a molecular weight of 283.35 g/mol, XLogP of 3.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(3-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 2894533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).