7-methoxy-2,3-dimethylquinoline

C12H13NO — CID 58717059

IUPAC7-methoxy-2,3-dimethylquinoline
SMILESCOc1ccc2cc(C)c(C)nc2c1
InChIInChI=1S/C12H13NO/c1-8-6-10-4-5-11(14-3)7-12(10)13-9(8)2/h4-7H,1-3H3
InChIKeyUQSIDNNGBUIAFO-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.86
Rot. Bonds1

About 7-methoxy-2,3-dimethylquinoline

7-methoxy-2,3-dimethylquinoline (PubChem CID 58717059) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 7-methoxy-2,3-dimethylquinoline.

Molecular Properties

Compound Name7-methoxy-2,3-dimethylquinoline
PubChem CID58717059
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name7-methoxy-2,3-dimethylquinoline
SMILESCOc1ccc2cc(C)c(C)nc2c1
InChIInChI=1S/C12H13NO/c1-8-6-10-4-5-11(14-3)7-12(10)13-9(8)2/h4-7H,1-3H3
InChIKeyUQSIDNNGBUIAFO-UHFFFAOYSA-N
XLogP2.86
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2,3-dimethylquinoline?
The IUPAC name of 7-methoxy-2,3-dimethylquinoline (CID 58717059) is 7-methoxy-2,3-dimethylquinoline.
What is the SMILES notation for 7-methoxy-2,3-dimethylquinoline?
The canonical SMILES for 7-methoxy-2,3-dimethylquinoline is COc1ccc2cc(C)c(C)nc2c1.
What is the InChIKey of 7-methoxy-2,3-dimethylquinoline?
The InChIKey is UQSIDNNGBUIAFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-8-6-10-4-5-11(14-3)7-12(10)13-9(8)2/h4-7H,1-3H3.
What are the key properties of 7-methoxy-2,3-dimethylquinoline?
7-methoxy-2,3-dimethylquinoline has a molecular weight of 187.24 g/mol, XLogP of 2.86, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2,3-dimethylquinoline is sourced from PubChem (CID 58717059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).