2,4-dimethoxy-7-methylquinoline

C12H13NO2 — CID 70166740

IUPAC2,4-dimethoxy-7-methylquinoline
SMILESCOc1cc(OC)c2ccc(C)cc2n1
InChIInChI=1S/C12H13NO2/c1-8-4-5-9-10(6-8)13-12(15-3)7-11(9)14-2/h4-7H,1-3H3
InChIKeyPEYVQEMTQKJZCA-UHFFFAOYSA-N
MW203.24 g/mol
LogP2.56
Rot. Bonds2

About 2,4-dimethoxy-7-methylquinoline

2,4-dimethoxy-7-methylquinoline (PubChem CID 70166740) has the molecular formula C12H13NO2 and a molecular weight of 203.24 g/mol. Its IUPAC name is 2,4-dimethoxy-7-methylquinoline.

Molecular Properties

Compound Name2,4-dimethoxy-7-methylquinoline
PubChem CID70166740
Molecular FormulaC12H13NO2
Molecular Weight203.24 g/mol
Exact Mass203.09
IUPAC Name2,4-dimethoxy-7-methylquinoline
SMILESCOc1cc(OC)c2ccc(C)cc2n1
InChIInChI=1S/C12H13NO2/c1-8-4-5-9-10(6-8)13-12(15-3)7-11(9)14-2/h4-7H,1-3H3
InChIKeyPEYVQEMTQKJZCA-UHFFFAOYSA-N
XLogP2.56
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-7-methylquinoline?
The IUPAC name of 2,4-dimethoxy-7-methylquinoline (CID 70166740) is 2,4-dimethoxy-7-methylquinoline.
What is the SMILES notation for 2,4-dimethoxy-7-methylquinoline?
The canonical SMILES for 2,4-dimethoxy-7-methylquinoline is COc1cc(OC)c2ccc(C)cc2n1.
What is the InChIKey of 2,4-dimethoxy-7-methylquinoline?
The InChIKey is PEYVQEMTQKJZCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO2/c1-8-4-5-9-10(6-8)13-12(15-3)7-11(9)14-2/h4-7H,1-3H3.
What are the key properties of 2,4-dimethoxy-7-methylquinoline?
2,4-dimethoxy-7-methylquinoline has a molecular weight of 203.24 g/mol, XLogP of 2.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-7-methylquinoline is sourced from PubChem (CID 70166740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).