[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone

C19H17F2NO2 — CID 1438163

IUPAC[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C19H17F2NO2/c20-16-6-4-13(5-7-16)18(23)14-8-10-22(11-9-14)19(24)15-2-1-3-17(21)12-15/h1-7,12,14H,8-11H2
InChIKeyDLDOSTSVPYZTKU-UHFFFAOYSA-N
MW329.35 g/mol
LogP3.70
Rot. Bonds3

About [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone

[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone (PubChem CID 1438163) has the molecular formula C19H17F2NO2 and a molecular weight of 329.35 g/mol. Its IUPAC name is [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone
PubChem CID1438163
Molecular FormulaC19H17F2NO2
Molecular Weight329.35 g/mol
Exact Mass329.12
IUPAC Name[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C19H17F2NO2/c20-16-6-4-13(5-7-16)18(23)14-8-10-22(11-9-14)19(24)15-2-1-3-17(21)12-15/h1-7,12,14H,8-11H2
InChIKeyDLDOSTSVPYZTKU-UHFFFAOYSA-N
XLogP3.70
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.35
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone?
The IUPAC name of [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone (CID 1438163) is [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone.
What is the SMILES notation for [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone?
The canonical SMILES for [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone is O=C(c1ccc(F)cc1)C1CCN(C(=O)c2cccc(F)c2)CC1.
What is the InChIKey of [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone?
The InChIKey is DLDOSTSVPYZTKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17F2NO2/c20-16-6-4-13(5-7-16)18(23)14-8-10-22(11-9-14)19(24)15-2-1-3-17(21)12-15/h1-7,12,14H,8-11H2.
What are the key properties of [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone?
[1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone has a molecular weight of 329.35 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluorobenzoyl)piperidin-4-yl]-(4-fluorophenyl)methanone is sourced from PubChem (CID 1438163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).