2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine

C20H26N2O3 — CID 69156389

IUPAC2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine
SMILESCOCCOc1ncccc1OCC1CNCCC1c1ccccc1
InChIInChI=1S/C20H26N2O3/c1-23-12-13-24-20-19(8-5-10-22-20)25-15-17-14-21-11-9-18(17)16-6-3-2-4-7-16/h2-8,10,17-18,21H,9,11-15H2,1H3
InChIKeyYWOJKSUKPYWJEY-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.88
Rot. Bonds8

About 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine

2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine (PubChem CID 69156389) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine
PubChem CID69156389
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC Name2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine
SMILESCOCCOc1ncccc1OCC1CNCCC1c1ccccc1
InChIInChI=1S/C20H26N2O3/c1-23-12-13-24-20-19(8-5-10-22-20)25-15-17-14-21-11-9-18(17)16-6-3-2-4-7-16/h2-8,10,17-18,21H,9,11-15H2,1H3
InChIKeyYWOJKSUKPYWJEY-UHFFFAOYSA-N
XLogP2.88
TPSA52.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine?
The IUPAC name of 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine (CID 69156389) is 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine.
What is the SMILES notation for 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine?
The canonical SMILES for 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine is COCCOc1ncccc1OCC1CNCCC1c1ccccc1.
What is the InChIKey of 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine?
The InChIKey is YWOJKSUKPYWJEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-23-12-13-24-20-19(8-5-10-22-20)25-15-17-14-21-11-9-18(17)16-6-3-2-4-7-16/h2-8,10,17-18,21H,9,11-15H2,1H3.
What are the key properties of 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine?
2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine has a molecular weight of 342.44 g/mol, XLogP of 2.88, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-3-[(4-phenylpiperidin-3-yl)methoxy]pyridine is sourced from PubChem (CID 69156389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).