2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one

C13H11N3O — CID 11148828

IUPAC2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one
SMILESCc1ccc2[nH]c(=O)c3ccc(C)nc3c2n1
InChIInChI=1S/C13H11N3O/c1-7-3-5-9-11(14-7)12-10(16-13(9)17)6-4-8(2)15-12/h3-6H,1-2H3,(H,16,17)
InChIKeyYWNFMBCJJCFGDK-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.09
Rot. Bonds

About 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one

2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one (PubChem CID 11148828) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one.

Molecular Properties

Compound Name2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one
PubChem CID11148828
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one
SMILESCc1ccc2[nH]c(=O)c3ccc(C)nc3c2n1
InChIInChI=1S/C13H11N3O/c1-7-3-5-9-11(14-7)12-10(16-13(9)17)6-4-8(2)15-12/h3-6H,1-2H3,(H,16,17)
InChIKeyYWNFMBCJJCFGDK-UHFFFAOYSA-N
XLogP2.09
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one?
The IUPAC name of 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one (CID 11148828) is 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one.
What is the SMILES notation for 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one?
The canonical SMILES for 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one is Cc1ccc2[nH]c(=O)c3ccc(C)nc3c2n1.
What is the InChIKey of 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one?
The InChIKey is YWNFMBCJJCFGDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-7-3-5-9-11(14-7)12-10(16-13(9)17)6-4-8(2)15-12/h3-6H,1-2H3,(H,16,17).
What are the key properties of 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one?
2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one has a molecular weight of 225.25 g/mol, XLogP of 2.09, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-dimethyl-5H-pyrido[3,2-c][1,5]naphthyridin-6-one is sourced from PubChem (CID 11148828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).