2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine

C7H13NO — CID 141294544

IUPAC2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine
SMILESCOC1CCCC(C)=N1
InChIInChI=1S/C7H13NO/c1-6-4-3-5-7(8-6)9-2/h7H,3-5H2,1-2H3
InChIKeyQXQNLTZAFFZIAM-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.60
Rot. Bonds1

About 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine

2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine (PubChem CID 141294544) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine.

Molecular Properties

Compound Name2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine
PubChem CID141294544
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine
SMILESCOC1CCCC(C)=N1
InChIInChI=1S/C7H13NO/c1-6-4-3-5-7(8-6)9-2/h7H,3-5H2,1-2H3
InChIKeyQXQNLTZAFFZIAM-UHFFFAOYSA-N
XLogP1.60
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine?
The IUPAC name of 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine (CID 141294544) is 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine.
What is the SMILES notation for 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine?
The canonical SMILES for 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine is COC1CCCC(C)=N1.
What is the InChIKey of 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine?
The InChIKey is QXQNLTZAFFZIAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-6-4-3-5-7(8-6)9-2/h7H,3-5H2,1-2H3.
What are the key properties of 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine?
2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine has a molecular weight of 127.19 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-6-methyl-2,3,4,5-tetrahydropyridine is sourced from PubChem (CID 141294544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).