1,3,5-trimethylbenzo[c][2,6]naphthyridine

C15H14N2 — CID 118895235

IUPAC1,3,5-trimethylbenzo[c][2,6]naphthyridine
SMILESCc1cc2c(C)nc3ccccc3c2c(C)n1
InChIInChI=1S/C15H14N2/c1-9-8-13-10(2)17-14-7-5-4-6-12(14)15(13)11(3)16-9/h4-8H,1-3H3
InChIKeyFQDUIISIWMMZRR-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.71
Rot. Bonds

About 1,3,5-trimethylbenzo[c][2,6]naphthyridine

1,3,5-trimethylbenzo[c][2,6]naphthyridine (PubChem CID 118895235) has the molecular formula C15H14N2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1,3,5-trimethylbenzo[c][2,6]naphthyridine.

Molecular Properties

Compound Name1,3,5-trimethylbenzo[c][2,6]naphthyridine
PubChem CID118895235
Molecular FormulaC15H14N2
Molecular Weight222.29 g/mol
Exact Mass222.12
IUPAC Name1,3,5-trimethylbenzo[c][2,6]naphthyridine
SMILESCc1cc2c(C)nc3ccccc3c2c(C)n1
InChIInChI=1S/C15H14N2/c1-9-8-13-10(2)17-14-7-5-4-6-12(14)15(13)11(3)16-9/h4-8H,1-3H3
InChIKeyFQDUIISIWMMZRR-UHFFFAOYSA-N
XLogP3.71
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

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CID 154591792
1,4-dimethoxy-5-methylpyridazino[4,5-c]quinoline
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2-methylquinolin-4-amine
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(2-methylquinolin-4-yl)methanethiol
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4-methylquinazoline-2-carboxylic acid
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4-methyl-2-propylquinazoline
CID 102028335
2-(2-methylquinolin-4-yl)acetic acid
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Frequently Asked Questions

What is the IUPAC name of 1,3,5-trimethylbenzo[c][2,6]naphthyridine?
The IUPAC name of 1,3,5-trimethylbenzo[c][2,6]naphthyridine (CID 118895235) is 1,3,5-trimethylbenzo[c][2,6]naphthyridine.
What is the SMILES notation for 1,3,5-trimethylbenzo[c][2,6]naphthyridine?
The canonical SMILES for 1,3,5-trimethylbenzo[c][2,6]naphthyridine is Cc1cc2c(C)nc3ccccc3c2c(C)n1.
What is the InChIKey of 1,3,5-trimethylbenzo[c][2,6]naphthyridine?
The InChIKey is FQDUIISIWMMZRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-9-8-13-10(2)17-14-7-5-4-6-12(14)15(13)11(3)16-9/h4-8H,1-3H3.
What are the key properties of 1,3,5-trimethylbenzo[c][2,6]naphthyridine?
1,3,5-trimethylbenzo[c][2,6]naphthyridine has a molecular weight of 222.29 g/mol, XLogP of 3.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,5-trimethylbenzo[c][2,6]naphthyridine is sourced from PubChem (CID 118895235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).