4-methoxy-1-methyl-8aH-quinoline

C11H13NO — CID 163176137

IUPAC4-methoxy-1-methyl-8aH-quinoline
SMILESCOC1=C2C=CC=CC2N(C)C=C1
InChIInChI=1S/C11H13NO/c1-12-8-7-11(13-2)9-5-3-4-6-10(9)12/h3-8,10H,1-2H3
InChIKeyOXLGIAHOINLSLY-UHFFFAOYSA-N
MW175.23 g/mol
LogP1.84
Rot. Bonds1

About 4-methoxy-1-methyl-8aH-quinoline

4-methoxy-1-methyl-8aH-quinoline (PubChem CID 163176137) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 4-methoxy-1-methyl-8aH-quinoline.

Molecular Properties

Compound Name4-methoxy-1-methyl-8aH-quinoline
PubChem CID163176137
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name4-methoxy-1-methyl-8aH-quinoline
SMILESCOC1=C2C=CC=CC2N(C)C=C1
InChIInChI=1S/C11H13NO/c1-12-8-7-11(13-2)9-5-3-4-6-10(9)12/h3-8,10H,1-2H3
InChIKeyOXLGIAHOINLSLY-UHFFFAOYSA-N
XLogP1.84
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-methyl-8aH-quinoline?
The IUPAC name of 4-methoxy-1-methyl-8aH-quinoline (CID 163176137) is 4-methoxy-1-methyl-8aH-quinoline.
What is the SMILES notation for 4-methoxy-1-methyl-8aH-quinoline?
The canonical SMILES for 4-methoxy-1-methyl-8aH-quinoline is COC1=C2C=CC=CC2N(C)C=C1.
What is the InChIKey of 4-methoxy-1-methyl-8aH-quinoline?
The InChIKey is OXLGIAHOINLSLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-12-8-7-11(13-2)9-5-3-4-6-10(9)12/h3-8,10H,1-2H3.
What are the key properties of 4-methoxy-1-methyl-8aH-quinoline?
4-methoxy-1-methyl-8aH-quinoline has a molecular weight of 175.23 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-methyl-8aH-quinoline is sourced from PubChem (CID 163176137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).