2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine

C18H21FN2O — CID 25263331

IUPAC2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine
SMILESCc1c(C2CCNCC2)ccnc1OCc1ccccc1F
InChIInChI=1S/C18H21FN2O/c1-13-16(14-6-9-20-10-7-14)8-11-21-18(13)22-12-15-4-2-3-5-17(15)19/h2-5,8,11,14,20H,6-7,9-10,12H2,1H3
InChIKeyHXOPTJFXVGDXBQ-UHFFFAOYSA-N
MW300.38 g/mol
LogP3.58
Rot. Bonds4

About 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine

2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine (PubChem CID 25263331) has the molecular formula C18H21FN2O and a molecular weight of 300.38 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine
PubChem CID25263331
Molecular FormulaC18H21FN2O
Molecular Weight300.38 g/mol
Exact Mass300.16
IUPAC Name2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine
SMILESCc1c(C2CCNCC2)ccnc1OCc1ccccc1F
InChIInChI=1S/C18H21FN2O/c1-13-16(14-6-9-20-10-7-14)8-11-21-18(13)22-12-15-4-2-3-5-17(15)19/h2-5,8,11,14,20H,6-7,9-10,12H2,1H3
InChIKeyHXOPTJFXVGDXBQ-UHFFFAOYSA-N
XLogP3.58
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine (CID 25263331) is 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine is Cc1c(C2CCNCC2)ccnc1OCc1ccccc1F.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine?
The InChIKey is HXOPTJFXVGDXBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2O/c1-13-16(14-6-9-20-10-7-14)8-11-21-18(13)22-12-15-4-2-3-5-17(15)19/h2-5,8,11,14,20H,6-7,9-10,12H2,1H3.
What are the key properties of 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine?
2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine has a molecular weight of 300.38 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-3-methyl-4-piperidin-4-ylpyridine is sourced from PubChem (CID 25263331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).