ethane;methane;2-methoxypyridine

C9H17NO — CID 142448470

IUPACethane;methane;2-methoxypyridine
SMILESC.CC.COc1ccccn1
InChIInChI=1S/C6H7NO.C2H6.CH4/c1-8-6-4-2-3-5-7-6;1-2;/h2-5H,1H3;1-2H3;1H4
InChIKeyBAOBJECTNAEKBY-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.75
Rot. Bonds1

About ethane;methane;2-methoxypyridine

ethane;methane;2-methoxypyridine (PubChem CID 142448470) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is ethane;methane;2-methoxypyridine.

Molecular Properties

Compound Nameethane;methane;2-methoxypyridine
PubChem CID142448470
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Nameethane;methane;2-methoxypyridine
SMILESC.CC.COc1ccccn1
InChIInChI=1S/C6H7NO.C2H6.CH4/c1-8-6-4-2-3-5-7-6;1-2;/h2-5H,1H3;1-2H3;1H4
InChIKeyBAOBJECTNAEKBY-UHFFFAOYSA-N
XLogP2.75
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxypyridine
CID 71774587
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CID 91802250
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CID 90835857
2-deuterio-6-methoxypyridine
CID 11137119
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Frequently Asked Questions

What is the IUPAC name of ethane;methane;2-methoxypyridine?
The IUPAC name of ethane;methane;2-methoxypyridine (CID 142448470) is ethane;methane;2-methoxypyridine.
What is the SMILES notation for ethane;methane;2-methoxypyridine?
The canonical SMILES for ethane;methane;2-methoxypyridine is C.CC.COc1ccccn1.
What is the InChIKey of ethane;methane;2-methoxypyridine?
The InChIKey is BAOBJECTNAEKBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO.C2H6.CH4/c1-8-6-4-2-3-5-7-6;1-2;/h2-5H,1H3;1-2H3;1H4.
What are the key properties of ethane;methane;2-methoxypyridine?
ethane;methane;2-methoxypyridine has a molecular weight of 155.24 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;2-methoxypyridine is sourced from PubChem (CID 142448470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).