2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine

C19H23FN2O2 — CID 68594912

IUPAC2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine
SMILESCc1ccc(OC[C@H]2CCCNC2)c(Oc2ccc(F)cc2C)n1
InChIInChI=1S/C19H23FN2O2/c1-13-10-16(20)6-8-17(13)24-19-18(7-5-14(2)22-19)23-12-15-4-3-9-21-11-15/h5-8,10,15,21H,3-4,9,11-12H2,1-2H3/t15-/m0/s1
InChIKeyJZXOFXGITSULLP-HNNXBMFYSA-N
MW330.40 g/mol
LogP4.01
Rot. Bonds5

About 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine

2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine (PubChem CID 68594912) has the molecular formula C19H23FN2O2 and a molecular weight of 330.40 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine
PubChem CID68594912
Molecular FormulaC19H23FN2O2
Molecular Weight330.40 g/mol
Exact Mass330.17
IUPAC Name2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine
SMILESCc1ccc(OC[C@H]2CCCNC2)c(Oc2ccc(F)cc2C)n1
InChIInChI=1S/C19H23FN2O2/c1-13-10-16(20)6-8-17(13)24-19-18(7-5-14(2)22-19)23-12-15-4-3-9-21-11-15/h5-8,10,15,21H,3-4,9,11-12H2,1-2H3/t15-/m0/s1
InChIKeyJZXOFXGITSULLP-HNNXBMFYSA-N
XLogP4.01
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.40
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine?
The IUPAC name of 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine (CID 68594912) is 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine.
What is the SMILES notation for 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine?
The canonical SMILES for 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine is Cc1ccc(OC[C@H]2CCCNC2)c(Oc2ccc(F)cc2C)n1.
What is the InChIKey of 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine?
The InChIKey is JZXOFXGITSULLP-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H23FN2O2/c1-13-10-16(20)6-8-17(13)24-19-18(7-5-14(2)22-19)23-12-15-4-3-9-21-11-15/h5-8,10,15,21H,3-4,9,11-12H2,1-2H3/t15-/m0/s1.
What are the key properties of 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine?
2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine has a molecular weight of 330.40 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenoxy)-6-methyl-3-[[(3S)-piperidin-3-yl]methoxy]pyridine is sourced from PubChem (CID 68594912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).