6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine

C22H16N2O — CID 134155915

IUPAC6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine
SMILESCOc1cccc(-c2nc3cccnc3c3c2Cc2ccccc2-3)c1
InChIInChI=1S/C22H16N2O/c1-25-16-8-4-7-15(12-16)21-18-13-14-6-2-3-9-17(14)20(18)22-19(24-21)10-5-11-23-22/h2-12H,13H2,1H3
InChIKeyHHPBXIIMDJGMKH-UHFFFAOYSA-N
MW324.38 g/mol
LogP4.88
Rot. Bonds2

About 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine

6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine (PubChem CID 134155915) has the molecular formula C22H16N2O and a molecular weight of 324.38 g/mol. Its IUPAC name is 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine.

Molecular Properties

Compound Name6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine
PubChem CID134155915
Molecular FormulaC22H16N2O
Molecular Weight324.38 g/mol
Exact Mass324.13
IUPAC Name6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine
SMILESCOc1cccc(-c2nc3cccnc3c3c2Cc2ccccc2-3)c1
InChIInChI=1S/C22H16N2O/c1-25-16-8-4-7-15(12-16)21-18-13-14-6-2-3-9-17(14)20(18)22-19(24-21)10-5-11-23-22/h2-12H,13H2,1H3
InChIKeyHHPBXIIMDJGMKH-UHFFFAOYSA-N
XLogP4.88
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine?
The IUPAC name of 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine (CID 134155915) is 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine.
What is the SMILES notation for 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine?
The canonical SMILES for 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine is COc1cccc(-c2nc3cccnc3c3c2Cc2ccccc2-3)c1.
What is the InChIKey of 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine?
The InChIKey is HHPBXIIMDJGMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O/c1-25-16-8-4-7-15(12-16)21-18-13-14-6-2-3-9-17(14)20(18)22-19(24-21)10-5-11-23-22/h2-12H,13H2,1H3.
What are the key properties of 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine?
6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine has a molecular weight of 324.38 g/mol, XLogP of 4.88, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenyl)-7H-indeno[2,1-c][1,5]naphthyridine is sourced from PubChem (CID 134155915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).