2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine

C23H24N2O — CID 45270576

IUPAC2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine
SMILESc1ccc(-c2ccccc2OC(c2ccccn2)C2CCNCC2)cc1
InChIInChI=1S/C23H24N2O/c1-2-8-18(9-3-1)20-10-4-5-12-22(20)26-23(19-13-16-24-17-14-19)21-11-6-7-15-25-21/h1-12,15,19,23-24H,13-14,16-17H2
InChIKeyGNYXJFDSZWNBKT-UHFFFAOYSA-N
MW344.46 g/mol
LogP4.87
Rot. Bonds5

About 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine

2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine (PubChem CID 45270576) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine.

Molecular Properties

Compound Name2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine
PubChem CID45270576
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC Name2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine
SMILESc1ccc(-c2ccccc2OC(c2ccccn2)C2CCNCC2)cc1
InChIInChI=1S/C23H24N2O/c1-2-8-18(9-3-1)20-10-4-5-12-22(20)26-23(19-13-16-24-17-14-19)21-11-6-7-15-25-21/h1-12,15,19,23-24H,13-14,16-17H2
InChIKeyGNYXJFDSZWNBKT-UHFFFAOYSA-N
XLogP4.87
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine?
The IUPAC name of 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine (CID 45270576) is 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine.
What is the SMILES notation for 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine?
The canonical SMILES for 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine is c1ccc(-c2ccccc2OC(c2ccccn2)C2CCNCC2)cc1.
What is the InChIKey of 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine?
The InChIKey is GNYXJFDSZWNBKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O/c1-2-8-18(9-3-1)20-10-4-5-12-22(20)26-23(19-13-16-24-17-14-19)21-11-6-7-15-25-21/h1-12,15,19,23-24H,13-14,16-17H2.
What are the key properties of 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine?
2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine has a molecular weight of 344.46 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylphenoxy)-piperidin-4-ylmethyl]pyridine is sourced from PubChem (CID 45270576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).