2-phenyl-5-(piperidin-4-ylmethoxy)pyridine

C17H20N2O — CID 127025530

IUPAC2-phenyl-5-(piperidin-4-ylmethoxy)pyridine
SMILESc1ccc(-c2ccc(OCC3CCNCC3)cn2)cc1
InChIInChI=1S/C17H20N2O/c1-2-4-15(5-3-1)17-7-6-16(12-19-17)20-13-14-8-10-18-11-9-14/h1-7,12,14,18H,8-11,13H2
InChIKeyRNXHBAQFPFYFRB-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.13
Rot. Bonds4

About 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine

2-phenyl-5-(piperidin-4-ylmethoxy)pyridine (PubChem CID 127025530) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine.

Molecular Properties

Compound Name2-phenyl-5-(piperidin-4-ylmethoxy)pyridine
PubChem CID127025530
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-phenyl-5-(piperidin-4-ylmethoxy)pyridine
SMILESc1ccc(-c2ccc(OCC3CCNCC3)cn2)cc1
InChIInChI=1S/C17H20N2O/c1-2-4-15(5-3-1)17-7-6-16(12-19-17)20-13-14-8-10-18-11-9-14/h1-7,12,14,18H,8-11,13H2
InChIKeyRNXHBAQFPFYFRB-UHFFFAOYSA-N
XLogP3.13
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine?
The IUPAC name of 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine (CID 127025530) is 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine.
What is the SMILES notation for 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine?
The canonical SMILES for 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine is c1ccc(-c2ccc(OCC3CCNCC3)cn2)cc1.
What is the InChIKey of 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine?
The InChIKey is RNXHBAQFPFYFRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-4-15(5-3-1)17-7-6-16(12-19-17)20-13-14-8-10-18-11-9-14/h1-7,12,14,18H,8-11,13H2.
What are the key properties of 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine?
2-phenyl-5-(piperidin-4-ylmethoxy)pyridine has a molecular weight of 268.36 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-(piperidin-4-ylmethoxy)pyridine is sourced from PubChem (CID 127025530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).