11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline

C26H18N2 — CID 126483447

IUPAC11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline
SMILESCc1cccn2c1cc1c3ccccc3nc(-c3cccc4ccccc34)c12
InChIInChI=1S/C26H18N2/c1-17-8-7-15-28-24(17)16-22-20-12-4-5-14-23(20)27-25(26(22)28)21-13-6-10-18-9-2-3-11-19(18)21/h2-16H,1H3
InChIKeyKVCOXSJEVVMBAS-UHFFFAOYSA-N
MW358.44 g/mol
LogP6.77
Rot. Bonds1

About 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline

11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline (PubChem CID 126483447) has the molecular formula C26H18N2 and a molecular weight of 358.44 g/mol. Its IUPAC name is 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline.

Molecular Properties

Compound Name11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline
PubChem CID126483447
Molecular FormulaC26H18N2
Molecular Weight358.44 g/mol
Exact Mass358.15
IUPAC Name11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline
SMILESCc1cccn2c1cc1c3ccccc3nc(-c3cccc4ccccc34)c12
InChIInChI=1S/C26H18N2/c1-17-8-7-15-28-24(17)16-22-20-12-4-5-14-23(20)27-25(26(22)28)21-13-6-10-18-9-2-3-11-19(18)21/h2-16H,1H3
InChIKeyKVCOXSJEVVMBAS-UHFFFAOYSA-N
XLogP6.77
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.44
LogP ≤ 56.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline?
The IUPAC name of 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline (CID 126483447) is 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline.
What is the SMILES notation for 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline?
The canonical SMILES for 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline is Cc1cccn2c1cc1c3ccccc3nc(-c3cccc4ccccc34)c12.
What is the InChIKey of 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline?
The InChIKey is KVCOXSJEVVMBAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N2/c1-17-8-7-15-28-24(17)16-22-20-12-4-5-14-23(20)27-25(26(22)28)21-13-6-10-18-9-2-3-11-19(18)21/h2-16H,1H3.
What are the key properties of 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline?
11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline has a molecular weight of 358.44 g/mol, XLogP of 6.77, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-6-naphthalen-1-ylindolizino[3,2-c]quinoline is sourced from PubChem (CID 126483447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).