3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine

C15H24N2O — CID 18712952

IUPAC3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine
SMILESCc1ncccc1OC1CCCN(C(C)(C)C)C1
InChIInChI=1S/C15H24N2O/c1-12-14(8-5-9-16-12)18-13-7-6-10-17(11-13)15(2,3)4/h5,8-9,13H,6-7,10-11H2,1-4H3
InChIKeyJTALVEVWYLVFMO-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.03
Rot. Bonds2

About 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine

3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine (PubChem CID 18712952) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine.

Molecular Properties

Compound Name3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine
PubChem CID18712952
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine
SMILESCc1ncccc1OC1CCCN(C(C)(C)C)C1
InChIInChI=1S/C15H24N2O/c1-12-14(8-5-9-16-12)18-13-7-6-10-17(11-13)15(2,3)4/h5,8-9,13H,6-7,10-11H2,1-4H3
InChIKeyJTALVEVWYLVFMO-UHFFFAOYSA-N
XLogP3.03
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-tert-butyl-3-(2-methylphenoxy)piperidine
CID 18712970
4-(1-tert-butylpiperidin-3-yl)oxypyridine
CID 138636947
4-(1-tert-butylpiperidin-3-yl)oxy-2-chloropyridine
CID 87418046
1-tert-butyl-3-(2-methylpyrazol-3-yl)oxypiperidine
CID 138636935
5-chloro-3-[(3S)-3-[(2-methyl-3-pyridinyl)oxy]pyrrolidin-1-yl]sulfonylpyridin-2-amine
CID 129328651
2-[6-amino-5-(1-tert-butylpiperidin-3-yl)oxypyridazin-3-yl]phenol
CID 137045913
2-methyl-3-[1-(3-methylsulfonylphenyl)sulfonylpyrrolidin-3-yl]oxypyridine
CID 128998572
2-methyl-3-[(3R)-1-(3-methylsulfonylphenyl)sulfonylpyrrolidin-3-yl]oxypyridine
CID 129337329
3-[[3-(2-chlorophenoxy)pyrrolidin-1-yl]methyl]-2-methylpyridine
CID 126774849
3-[(3S)-1-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonylpyrrolidin-3-yl]oxy-2-methylpyridine
CID 129338982
4-methyl-3-[(3S)-3-[(2-methyl-3-pyridinyl)oxy]pyrrolidin-1-yl]sulfonylbenzonitrile
CID 129337794
3-chloro-4-[3-[(2-methyl-3-pyridinyl)oxy]pyrrolidin-1-yl]sulfonylbenzonitrile
CID 128998573

Frequently Asked Questions

What is the IUPAC name of 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine?
The IUPAC name of 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine (CID 18712952) is 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine.
What is the SMILES notation for 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine?
The canonical SMILES for 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine is Cc1ncccc1OC1CCCN(C(C)(C)C)C1.
What is the InChIKey of 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine?
The InChIKey is JTALVEVWYLVFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-12-14(8-5-9-16-12)18-13-7-6-10-17(11-13)15(2,3)4/h5,8-9,13H,6-7,10-11H2,1-4H3.
What are the key properties of 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine?
3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine has a molecular weight of 248.37 g/mol, XLogP of 3.03, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-tert-butylpiperidin-3-yl)oxy-2-methylpyridine is sourced from PubChem (CID 18712952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).