5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine

C12H17NO2 — CID 144977855

IUPAC5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine
SMILESCOc1ccc(OCC2CC2(C)C)cn1
InChIInChI=1S/C12H17NO2/c1-12(2)6-9(12)8-15-10-4-5-11(14-3)13-7-10/h4-5,7,9H,6,8H2,1-3H3
InChIKeyTVNHFOHXYCXGGI-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.52
Rot. Bonds4

About 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine

5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine (PubChem CID 144977855) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine.

Molecular Properties

Compound Name5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine
PubChem CID144977855
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine
SMILESCOc1ccc(OCC2CC2(C)C)cn1
InChIInChI=1S/C12H17NO2/c1-12(2)6-9(12)8-15-10-4-5-11(14-3)13-7-10/h4-5,7,9H,6,8H2,1-3H3
InChIKeyTVNHFOHXYCXGGI-UHFFFAOYSA-N
XLogP2.52
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

S-anilinothiohydroxylamine;5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine
CID 144977854
5-[(2,2-difluorocyclopropyl)methoxy]pyridin-2-amine
CID 123838873
5-[[2-(2-ethylpyrazol-3-yl)cyclohexyl]methoxy]-2-methoxypyridine
CID 90427359
2-methoxy-5-(1-methylcyclopropyl)pyridine
CID 140857812
CID 59248881
CID 59248881
2-cyclohexyloxy-5-methoxypyridine
CID 170010378
5-[1-[(2S)-azetidin-2-yl]ethoxy]-2-methoxypyridine
CID 70083932
5-methoxy-2-[(2-methylpropan-2-yl)oxy]pyridine
CID 174590597
benzyl (2S)-2-[(6-methoxy-3-pyridinyl)oxymethyl]azetidine-1-carboxylate;2-methoxy-5-[[(2S)-1-methylazetidin-2-yl]methoxy]pyridine;dihydrochloride
CID 70101463
3-(6-methoxy-3-pyridinyl)-2,2-dimethylcyclopropan-1-amine
CID 130488531
2-methoxy-5-[(3R,4S)-3-methylpiperidin-4-yl]oxypyridine
CID 129278174
N-[(6-methoxy-3-pyridinyl)methyl]adamantan-1-amine
CID 114936254

Frequently Asked Questions

What is the IUPAC name of 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine?
The IUPAC name of 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine (CID 144977855) is 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine.
What is the SMILES notation for 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine?
The canonical SMILES for 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine is COc1ccc(OCC2CC2(C)C)cn1.
What is the InChIKey of 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine?
The InChIKey is TVNHFOHXYCXGGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-12(2)6-9(12)8-15-10-4-5-11(14-3)13-7-10/h4-5,7,9H,6,8H2,1-3H3.
What are the key properties of 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine?
5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine has a molecular weight of 207.27 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,2-dimethylcyclopropyl)methoxy]-2-methoxypyridine is sourced from PubChem (CID 144977855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).