4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine

C20H20FNO — CID 164628207

IUPAC4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine
SMILESFc1ccc(CN2CCC(c3cc4ccccc4o3)CC2)cc1
InChIInChI=1S/C20H20FNO/c21-18-7-5-15(6-8-18)14-22-11-9-16(10-12-22)20-13-17-3-1-2-4-19(17)23-20/h1-8,13,16H,9-12,14H2
InChIKeyGZCWMUIOKUAEEN-UHFFFAOYSA-N
MW309.38 g/mol
LogP4.95
Rot. Bonds3

About 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine

4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine (PubChem CID 164628207) has the molecular formula C20H20FNO and a molecular weight of 309.38 g/mol. Its IUPAC name is 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine.

Molecular Properties

Compound Name4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine
PubChem CID164628207
Molecular FormulaC20H20FNO
Molecular Weight309.38 g/mol
Exact Mass309.15
IUPAC Name4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine
SMILESFc1ccc(CN2CCC(c3cc4ccccc4o3)CC2)cc1
InChIInChI=1S/C20H20FNO/c21-18-7-5-15(6-8-18)14-22-11-9-16(10-12-22)20-13-17-3-1-2-4-19(17)23-20/h1-8,13,16H,9-12,14H2
InChIKeyGZCWMUIOKUAEEN-UHFFFAOYSA-N
XLogP4.95
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.38
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine?
The IUPAC name of 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine (CID 164628207) is 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine.
What is the SMILES notation for 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine?
The canonical SMILES for 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine is Fc1ccc(CN2CCC(c3cc4ccccc4o3)CC2)cc1.
What is the InChIKey of 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine?
The InChIKey is GZCWMUIOKUAEEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO/c21-18-7-5-15(6-8-18)14-22-11-9-16(10-12-22)20-13-17-3-1-2-4-19(17)23-20/h1-8,13,16H,9-12,14H2.
What are the key properties of 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine?
4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine has a molecular weight of 309.38 g/mol, XLogP of 4.95, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzofuran-2-yl)-1-[(4-fluorophenyl)methyl]piperidine is sourced from PubChem (CID 164628207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).