(1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone

C19H20FNO — CID 11779386

IUPAC(1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C19H20FNO/c20-18-8-6-16(7-9-18)19(22)17-10-12-21(13-11-17)14-15-4-2-1-3-5-15/h1-9,17H,10-14H2
InChIKeyQQJOPKBZXNOJRJ-UHFFFAOYSA-N
MW297.37 g/mol
LogP3.92
Rot. Bonds4

About (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone

(1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone (PubChem CID 11779386) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name(1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone
PubChem CID11779386
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC Name(1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C19H20FNO/c20-18-8-6-16(7-9-18)19(22)17-10-12-21(13-11-17)14-15-4-2-1-3-5-15/h1-9,17H,10-14H2
InChIKeyQQJOPKBZXNOJRJ-UHFFFAOYSA-N
XLogP3.92
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone?
The IUPAC name of (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone (CID 11779386) is (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone.
What is the SMILES notation for (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone?
The canonical SMILES for (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone is O=C(c1ccc(F)cc1)C1CCN(Cc2ccccc2)CC1.
What is the InChIKey of (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone?
The InChIKey is QQJOPKBZXNOJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO/c20-18-8-6-16(7-9-18)19(22)17-10-12-21(13-11-17)14-15-4-2-1-3-5-15/h1-9,17H,10-14H2.
What are the key properties of (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone?
(1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone has a molecular weight of 297.37 g/mol, XLogP of 3.92, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzylpiperidin-4-yl)-(4-fluorophenyl)methanone is sourced from PubChem (CID 11779386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).