4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine

C15H18FN3O — CID 164914755

IUPAC4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine
SMILESFc1ccc(COn2ccc(C3CCNCC3)n2)cc1
InChIInChI=1S/C15H18FN3O/c16-14-3-1-12(2-4-14)11-20-19-10-7-15(18-19)13-5-8-17-9-6-13/h1-4,7,10,13,17H,5-6,8-9,11H2
InChIKeyIRGQFQHALFWUAX-UHFFFAOYSA-N
MW275.33 g/mol
LogP2.12
Rot. Bonds4

About 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine

4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine (PubChem CID 164914755) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine.

Molecular Properties

Compound Name4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine
PubChem CID164914755
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC Name4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine
SMILESFc1ccc(COn2ccc(C3CCNCC3)n2)cc1
InChIInChI=1S/C15H18FN3O/c16-14-3-1-12(2-4-14)11-20-19-10-7-15(18-19)13-5-8-17-9-6-13/h1-4,7,10,13,17H,5-6,8-9,11H2
InChIKeyIRGQFQHALFWUAX-UHFFFAOYSA-N
XLogP2.12
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine?
The IUPAC name of 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine (CID 164914755) is 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine.
What is the SMILES notation for 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine?
The canonical SMILES for 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine is Fc1ccc(COn2ccc(C3CCNCC3)n2)cc1.
What is the InChIKey of 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine?
The InChIKey is IRGQFQHALFWUAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c16-14-3-1-12(2-4-14)11-20-19-10-7-15(18-19)13-5-8-17-9-6-13/h1-4,7,10,13,17H,5-6,8-9,11H2.
What are the key properties of 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine?
4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine has a molecular weight of 275.33 g/mol, XLogP of 2.12, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[(4-fluorophenyl)methoxy]pyrazol-3-yl]piperidine is sourced from PubChem (CID 164914755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).