2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine

C16H25NO2 — CID 176666572

IUPAC2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine
SMILESCc1cc(C(C)C)cnc1OC1CC(C)OC(C)C1
InChIInChI=1S/C16H25NO2/c1-10(2)14-6-11(3)16(17-9-14)19-15-7-12(4)18-13(5)8-15/h6,9-10,12-13,15H,7-8H2,1-5H3
InChIKeyGDFMMAWOPGXVHH-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.85
Rot. Bonds3

About 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine

2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine (PubChem CID 176666572) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine.

Molecular Properties

Compound Name2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine
PubChem CID176666572
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine
SMILESCc1cc(C(C)C)cnc1OC1CC(C)OC(C)C1
InChIInChI=1S/C16H25NO2/c1-10(2)14-6-11(3)16(17-9-14)19-15-7-12(4)18-13(5)8-15/h6,9-10,12-13,15H,7-8H2,1-5H3
InChIKeyGDFMMAWOPGXVHH-UHFFFAOYSA-N
XLogP3.85
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2R,6S)-2,6-dimethyloxan-4-yl]oxy-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CID 176666786
2-ethoxy-3-methyl-5-propan-2-ylpyridine
CID 130320628
[2-(2,6-dimethyloxan-4-yl)oxy-5-fluoro-3-pyridinyl]methanol
CID 114034719
6-(3,5-dimethylcyclohexyl)oxy-5-methylpyridin-3-amine
CID 64730372
2-[(2S,6R)-2,6-dimethyloxan-4-yl]oxy-5-ethyl-4-methylpyridine
CID 176666936
(1R)-1-[2-(2,6-dimethyloxan-4-yl)oxy-3-pyridinyl]ethanamine
CID 114056769
4-(2,6-dimethyloxan-4-yl)oxy-2-methylpyrimidine-5-carboxylic acid
CID 114213938
5-cyclopropyl-2-cyclopropyloxy-3-methylpyridine
CID 167079716
(1S)-1-[4-(2,6-dimethyloxan-4-yl)oxyphenyl]ethanamine
CID 113369198
5-bromo-3-methyl-2-(oxetan-3-yloxy)pyridine
CID 102607188
2-(oxolan-3-yloxy)-5-propan-2-yl-3-(trifluoromethyl)pyridine
CID 167302803
2-tert-butyl-3-methyl-5-propan-2-ylpyridine
CID 134415008

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine?
The IUPAC name of 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine (CID 176666572) is 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine.
What is the SMILES notation for 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine?
The canonical SMILES for 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine is Cc1cc(C(C)C)cnc1OC1CC(C)OC(C)C1.
What is the InChIKey of 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine?
The InChIKey is GDFMMAWOPGXVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-10(2)14-6-11(3)16(17-9-14)19-15-7-12(4)18-13(5)8-15/h6,9-10,12-13,15H,7-8H2,1-5H3.
What are the key properties of 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine?
2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine has a molecular weight of 263.38 g/mol, XLogP of 3.85, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethyloxan-4-yl)oxy-3-methyl-5-propan-2-ylpyridine is sourced from PubChem (CID 176666572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).