4-methoxy-2-propylquinoline

C13H15NO — CID 10352791

IUPAC4-methoxy-2-propylquinoline
SMILESCCCc1cc(OC)c2ccccc2n1
InChIInChI=1S/C13H15NO/c1-3-6-10-9-13(15-2)11-7-4-5-8-12(11)14-10/h4-5,7-9H,3,6H2,1-2H3
InChIKeyMWMFTWIDDQSBRA-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.20
Rot. Bonds3

About 4-methoxy-2-propylquinoline

4-methoxy-2-propylquinoline (PubChem CID 10352791) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-methoxy-2-propylquinoline.

Molecular Properties

Compound Name4-methoxy-2-propylquinoline
PubChem CID10352791
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name4-methoxy-2-propylquinoline
SMILESCCCc1cc(OC)c2ccccc2n1
InChIInChI=1S/C13H15NO/c1-3-6-10-9-13(15-2)11-7-4-5-8-12(11)14-10/h4-5,7-9H,3,6H2,1-2H3
InChIKeyMWMFTWIDDQSBRA-UHFFFAOYSA-N
XLogP3.20
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-propylquinoline?
The IUPAC name of 4-methoxy-2-propylquinoline (CID 10352791) is 4-methoxy-2-propylquinoline.
What is the SMILES notation for 4-methoxy-2-propylquinoline?
The canonical SMILES for 4-methoxy-2-propylquinoline is CCCc1cc(OC)c2ccccc2n1.
What is the InChIKey of 4-methoxy-2-propylquinoline?
The InChIKey is MWMFTWIDDQSBRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-3-6-10-9-13(15-2)11-7-4-5-8-12(11)14-10/h4-5,7-9H,3,6H2,1-2H3.
What are the key properties of 4-methoxy-2-propylquinoline?
4-methoxy-2-propylquinoline has a molecular weight of 201.27 g/mol, XLogP of 3.20, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-propylquinoline is sourced from PubChem (CID 10352791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).