1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine

C18H24FN — CID 24780671

IUPAC1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine
SMILESFc1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1
InChIInChI=1S/C18H24FN/c19-17-8-6-15(7-9-17)18(20-10-2-1-3-11-20)13-14-4-5-16(18)12-14/h6-9,14,16H,1-5,10-13H2
InChIKeyNZXZGRMNBJVVPF-UHFFFAOYSA-N
MW273.39 g/mol
LogP4.33
Rot. Bonds2

About 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine

1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine (PubChem CID 24780671) has the molecular formula C18H24FN and a molecular weight of 273.39 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine
PubChem CID24780671
Molecular FormulaC18H24FN
Molecular Weight273.39 g/mol
Exact Mass273.19
IUPAC Name1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine
SMILESFc1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1
InChIInChI=1S/C18H24FN/c19-17-8-6-15(7-9-17)18(20-10-2-1-3-11-20)13-14-4-5-16(18)12-14/h6-9,14,16H,1-5,10-13H2
InChIKeyNZXZGRMNBJVVPF-UHFFFAOYSA-N
XLogP4.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.39
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine?
The IUPAC name of 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine (CID 24780671) is 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine.
What is the SMILES notation for 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine?
The canonical SMILES for 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine is Fc1ccc(C2(N3CCCCC3)CC3CCC2C3)cc1.
What is the InChIKey of 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine?
The InChIKey is NZXZGRMNBJVVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN/c19-17-8-6-15(7-9-17)18(20-10-2-1-3-11-20)13-14-4-5-16(18)12-14/h6-9,14,16H,1-5,10-13H2.
What are the key properties of 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine?
1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine has a molecular weight of 273.39 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)-2-bicyclo[2.2.1]heptanyl]piperidine is sourced from PubChem (CID 24780671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).