6-(3-methoxyphenyl)indolizino[3,2-c]quinoline

C22H16N2O — CID 118970859

IUPAC6-(3-methoxyphenyl)indolizino[3,2-c]quinoline
SMILESCOc1cccc(-c2nc3ccccc3c3cc4ccccn4c23)c1
InChIInChI=1S/C22H16N2O/c1-25-17-9-6-7-15(13-17)21-22-19(14-16-8-4-5-12-24(16)22)18-10-2-3-11-20(18)23-21/h2-14H,1H3
InChIKeyLKGIOYFYOCVQLC-UHFFFAOYSA-N
MW324.38 g/mol
LogP5.32
Rot. Bonds2

About 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline

6-(3-methoxyphenyl)indolizino[3,2-c]quinoline (PubChem CID 118970859) has the molecular formula C22H16N2O and a molecular weight of 324.38 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline.

Molecular Properties

Compound Name6-(3-methoxyphenyl)indolizino[3,2-c]quinoline
PubChem CID118970859
Molecular FormulaC22H16N2O
Molecular Weight324.38 g/mol
Exact Mass324.13
IUPAC Name6-(3-methoxyphenyl)indolizino[3,2-c]quinoline
SMILESCOc1cccc(-c2nc3ccccc3c3cc4ccccn4c23)c1
InChIInChI=1S/C22H16N2O/c1-25-17-9-6-7-15(13-17)21-22-19(14-16-8-4-5-12-24(16)22)18-10-2-3-11-20(18)23-21/h2-14H,1H3
InChIKeyLKGIOYFYOCVQLC-UHFFFAOYSA-N
XLogP5.32
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.38
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline?
The IUPAC name of 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline (CID 118970859) is 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline.
What is the SMILES notation for 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline?
The canonical SMILES for 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline is COc1cccc(-c2nc3ccccc3c3cc4ccccn4c23)c1.
What is the InChIKey of 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline?
The InChIKey is LKGIOYFYOCVQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O/c1-25-17-9-6-7-15(13-17)21-22-19(14-16-8-4-5-12-24(16)22)18-10-2-3-11-20(18)23-21/h2-14H,1H3.
What are the key properties of 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline?
6-(3-methoxyphenyl)indolizino[3,2-c]quinoline has a molecular weight of 324.38 g/mol, XLogP of 5.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)indolizino[3,2-c]quinoline is sourced from PubChem (CID 118970859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).