5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine

C16H24N2O2 — CID 75484483

IUPAC5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine
SMILESCc1ccc(OC2CCN(CC3CCOC3)CC2)nc1
InChIInChI=1S/C16H24N2O2/c1-13-2-3-16(17-10-13)20-15-4-7-18(8-5-15)11-14-6-9-19-12-14/h2-3,10,14-15H,4-9,11-12H2,1H3
InChIKeyFHNQMCIKICELBL-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.27
Rot. Bonds4

About 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine

5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine (PubChem CID 75484483) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine.

Molecular Properties

Compound Name5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine
PubChem CID75484483
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine
SMILESCc1ccc(OC2CCN(CC3CCOC3)CC2)nc1
InChIInChI=1S/C16H24N2O2/c1-13-2-3-16(17-10-13)20-15-4-7-18(8-5-15)11-14-6-9-19-12-14/h2-3,10,14-15H,4-9,11-12H2,1H3
InChIKeyFHNQMCIKICELBL-UHFFFAOYSA-N
XLogP2.27
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine?
The IUPAC name of 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine (CID 75484483) is 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine.
What is the SMILES notation for 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine?
The canonical SMILES for 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine is Cc1ccc(OC2CCN(CC3CCOC3)CC2)nc1.
What is the InChIKey of 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine?
The InChIKey is FHNQMCIKICELBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-13-2-3-16(17-10-13)20-15-4-7-18(8-5-15)11-14-6-9-19-12-14/h2-3,10,14-15H,4-9,11-12H2,1H3.
What are the key properties of 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine?
5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine has a molecular weight of 276.38 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[1-(oxolan-3-ylmethyl)piperidin-4-yl]oxypyridine is sourced from PubChem (CID 75484483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).