3-methoxy-1,5-dimethyl-2-methylidenepyridine

C9H13NO — CID 145172202

IUPAC3-methoxy-1,5-dimethyl-2-methylidenepyridine
SMILESC=C1C(OC)=CC(C)=CN1C
InChIInChI=1S/C9H13NO/c1-7-5-9(11-4)8(2)10(3)6-7/h5-6H,2H2,1,3-4H3
InChIKeyOVOZAACFKORGNJ-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.88
Rot. Bonds1

About 3-methoxy-1,5-dimethyl-2-methylidenepyridine

3-methoxy-1,5-dimethyl-2-methylidenepyridine (PubChem CID 145172202) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-methoxy-1,5-dimethyl-2-methylidenepyridine.

Molecular Properties

Compound Name3-methoxy-1,5-dimethyl-2-methylidenepyridine
PubChem CID145172202
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name3-methoxy-1,5-dimethyl-2-methylidenepyridine
SMILESC=C1C(OC)=CC(C)=CN1C
InChIInChI=1S/C9H13NO/c1-7-5-9(11-4)8(2)10(3)6-7/h5-6H,2H2,1,3-4H3
InChIKeyOVOZAACFKORGNJ-UHFFFAOYSA-N
XLogP1.88
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1,5-dimethyl-2-methylidenepyridine?
The IUPAC name of 3-methoxy-1,5-dimethyl-2-methylidenepyridine (CID 145172202) is 3-methoxy-1,5-dimethyl-2-methylidenepyridine.
What is the SMILES notation for 3-methoxy-1,5-dimethyl-2-methylidenepyridine?
The canonical SMILES for 3-methoxy-1,5-dimethyl-2-methylidenepyridine is C=C1C(OC)=CC(C)=CN1C.
What is the InChIKey of 3-methoxy-1,5-dimethyl-2-methylidenepyridine?
The InChIKey is OVOZAACFKORGNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7-5-9(11-4)8(2)10(3)6-7/h5-6H,2H2,1,3-4H3.
What are the key properties of 3-methoxy-1,5-dimethyl-2-methylidenepyridine?
3-methoxy-1,5-dimethyl-2-methylidenepyridine has a molecular weight of 151.21 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1,5-dimethyl-2-methylidenepyridine is sourced from PubChem (CID 145172202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).