3-butan-2-yl-2-methoxypyridine

C10H15NO — CID 130368185

IUPAC3-butan-2-yl-2-methoxypyridine
SMILESCCC(C)c1cccnc1OC
InChIInChI=1S/C10H15NO/c1-4-8(2)9-6-5-7-11-10(9)12-3/h5-8H,4H2,1-3H3
InChIKeyZFGGASJSYDOYJK-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.60
Rot. Bonds3

About 3-butan-2-yl-2-methoxypyridine

3-butan-2-yl-2-methoxypyridine (PubChem CID 130368185) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 3-butan-2-yl-2-methoxypyridine.

Molecular Properties

Compound Name3-butan-2-yl-2-methoxypyridine
PubChem CID130368185
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name3-butan-2-yl-2-methoxypyridine
SMILESCCC(C)c1cccnc1OC
InChIInChI=1S/C10H15NO/c1-4-8(2)9-6-5-7-11-10(9)12-3/h5-8H,4H2,1-3H3
InChIKeyZFGGASJSYDOYJK-UHFFFAOYSA-N
XLogP2.60
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-methoxy-3-propan-2-ylpyridine
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(1R)-1-(2-methoxy-3-pyridinyl)-N-methylethanamine
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2-methoxy-3-[(2R)-3-methylbutan-2-yl]pyridine
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1-(2-methoxy-3-pyridinyl)propylhydrazine
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3-(2-methoxy-3-pyridinyl)-4-methylhexanenitrile
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N-tert-butyl-4-(2-methoxy-3-pyridinyl)pentan-1-amine
CID 58313525
1-amino-1-(2-methoxy-3-pyridinyl)propan-2-ol
CID 55292838
2-ethoxy-3-propan-2-ylpyridine
CID 58551728
3-butan-2-yl-N,N-dimethylpyridin-2-amine
CID 129162816
1-(2-methoxy-3-pyridinyl)-N-methylpentan-1-amine
CID 105125538
1-(2-methoxy-3-pyridinyl)octan-1-amine
CID 105124612
2-(4-ethylphenyl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105101378

Frequently Asked Questions

What is the IUPAC name of 3-butan-2-yl-2-methoxypyridine?
The IUPAC name of 3-butan-2-yl-2-methoxypyridine (CID 130368185) is 3-butan-2-yl-2-methoxypyridine.
What is the SMILES notation for 3-butan-2-yl-2-methoxypyridine?
The canonical SMILES for 3-butan-2-yl-2-methoxypyridine is CCC(C)c1cccnc1OC.
What is the InChIKey of 3-butan-2-yl-2-methoxypyridine?
The InChIKey is ZFGGASJSYDOYJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-4-8(2)9-6-5-7-11-10(9)12-3/h5-8H,4H2,1-3H3.
What are the key properties of 3-butan-2-yl-2-methoxypyridine?
3-butan-2-yl-2-methoxypyridine has a molecular weight of 165.24 g/mol, XLogP of 2.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butan-2-yl-2-methoxypyridine is sourced from PubChem (CID 130368185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).