2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine

C16H18FN3O — CID 172893124

IUPAC2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine
SMILESFc1cccc(OC2CCN(Cc3ccccn3)CC2)n1
InChIInChI=1S/C16H18FN3O/c17-15-5-3-6-16(19-15)21-14-7-10-20(11-8-14)12-13-4-1-2-9-18-13/h1-6,9,14H,7-8,10-12H2
InChIKeyNZCJLGAIZGUTDB-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.66
Rot. Bonds4

About 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine

2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine (PubChem CID 172893124) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine.

Molecular Properties

Compound Name2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine
PubChem CID172893124
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC Name2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine
SMILESFc1cccc(OC2CCN(Cc3ccccn3)CC2)n1
InChIInChI=1S/C16H18FN3O/c17-15-5-3-6-16(19-15)21-14-7-10-20(11-8-14)12-13-4-1-2-9-18-13/h1-6,9,14H,7-8,10-12H2
InChIKeyNZCJLGAIZGUTDB-UHFFFAOYSA-N
XLogP2.66
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-(1-benzylpyrrolidin-3-yl)oxy-6-fluoropyridine
CID 62916852
2-[[4-[3-(trifluoromethyl)phenoxy]piperidin-1-yl]methyl]pyridine
CID 56886415
2-fluoro-6-[1-[2-(triazol-2-yl)ethyl]pyrrolidin-3-yl]oxypyridine
CID 172904927
2-cyclopentyloxy-6-fluoropyridine
CID 61227788
2-[(4-bromopiperidin-1-yl)methyl]pyridine
CID 80680400
2-fluoro-6-[1-(3,3,3-trifluoropropyl)pyrrolidin-3-yl]oxypyridine
CID 172904787
2-[[4-(trifluoromethyl)piperidin-1-yl]methyl]pyridine
CID 131703770
2-[(4-fluorophenyl)methyl]-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine
CID 95809288
2-fluoro-6-[1-[(6-methoxy-3-pyridinyl)methyl]pyrrolidin-3-yl]oxypyridine
CID 171999952
2-[1-[(3,3-difluorocyclobutyl)methyl]pyrrolidin-3-yl]oxy-6-fluoropyridine
CID 172904789
[3-[(4-pyridin-2-yloxypiperidin-1-yl)methyl]-1,2,4-oxadiazol-5-yl]methanamine;dihydrochloride
CID 120752666
N-(cyclopropylmethyl)-1-(pyridin-2-ylmethyl)piperidin-4-amine
CID 78921206

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine?
The IUPAC name of 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine (CID 172893124) is 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine.
What is the SMILES notation for 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine?
The canonical SMILES for 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine is Fc1cccc(OC2CCN(Cc3ccccn3)CC2)n1.
What is the InChIKey of 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine?
The InChIKey is NZCJLGAIZGUTDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c17-15-5-3-6-16(19-15)21-14-7-10-20(11-8-14)12-13-4-1-2-9-18-13/h1-6,9,14H,7-8,10-12H2.
What are the key properties of 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine?
2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine has a molecular weight of 287.34 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]oxypyridine is sourced from PubChem (CID 172893124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).