6-ethyl-2-methoxyquinoline

C12H13NO — CID 134204287

IUPAC6-ethyl-2-methoxyquinoline
SMILESCCc1ccc2nc(OC)ccc2c1
InChIInChI=1S/C12H13NO/c1-3-9-4-6-11-10(8-9)5-7-12(13-11)14-2/h4-8H,3H2,1-2H3
InChIKeyRWGPYKVUCWMGTO-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.81
Rot. Bonds2

About 6-ethyl-2-methoxyquinoline

6-ethyl-2-methoxyquinoline (PubChem CID 134204287) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 6-ethyl-2-methoxyquinoline.

Molecular Properties

Compound Name6-ethyl-2-methoxyquinoline
PubChem CID134204287
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name6-ethyl-2-methoxyquinoline
SMILESCCc1ccc2nc(OC)ccc2c1
InChIInChI=1S/C12H13NO/c1-3-9-4-6-11-10(8-9)5-7-12(13-11)14-2/h4-8H,3H2,1-2H3
InChIKeyRWGPYKVUCWMGTO-UHFFFAOYSA-N
XLogP2.81
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methoxyquinoline?
The IUPAC name of 6-ethyl-2-methoxyquinoline (CID 134204287) is 6-ethyl-2-methoxyquinoline.
What is the SMILES notation for 6-ethyl-2-methoxyquinoline?
The canonical SMILES for 6-ethyl-2-methoxyquinoline is CCc1ccc2nc(OC)ccc2c1.
What is the InChIKey of 6-ethyl-2-methoxyquinoline?
The InChIKey is RWGPYKVUCWMGTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-3-9-4-6-11-10(8-9)5-7-12(13-11)14-2/h4-8H,3H2,1-2H3.
What are the key properties of 6-ethyl-2-methoxyquinoline?
6-ethyl-2-methoxyquinoline has a molecular weight of 187.24 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methoxyquinoline is sourced from PubChem (CID 134204287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).