7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine

C15H13N3 — CID 58462768

IUPAC7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine
SMILESC=c1cc2cc3cc(C)c(C)nc3nc2nc1=C
InChIInChI=1S/C15H13N3/c1-8-5-12-7-13-6-9(2)11(4)17-15(13)18-14(12)16-10(8)3/h5-7H,1,3H2,2,4H3
InChIKeyUKGMSHVKPMHNPB-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.62
Rot. Bonds

About 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine

7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine (PubChem CID 58462768) has the molecular formula C15H13N3 and a molecular weight of 235.29 g/mol. Its IUPAC name is 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine.

Molecular Properties

Compound Name7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine
PubChem CID58462768
Molecular FormulaC15H13N3
Molecular Weight235.29 g/mol
Exact Mass235.11
IUPAC Name7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine
SMILESC=c1cc2cc3cc(C)c(C)nc3nc2nc1=C
InChIInChI=1S/C15H13N3/c1-8-5-12-7-13-6-9(2)11(4)17-15(13)18-14(12)16-10(8)3/h5-7H,1,3H2,2,4H3
InChIKeyUKGMSHVKPMHNPB-UHFFFAOYSA-N
XLogP1.62
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine?
The IUPAC name of 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine (CID 58462768) is 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine.
What is the SMILES notation for 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine?
The canonical SMILES for 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine is C=c1cc2cc3cc(C)c(C)nc3nc2nc1=C.
What is the InChIKey of 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine?
The InChIKey is UKGMSHVKPMHNPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3/c1-8-5-12-7-13-6-9(2)11(4)17-15(13)18-14(12)16-10(8)3/h5-7H,1,3H2,2,4H3.
What are the key properties of 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine?
7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine has a molecular weight of 235.29 g/mol, XLogP of 1.62, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dimethyl-2,3-dimethylidenepyrido[2,3-b][1,8]naphthyridine is sourced from PubChem (CID 58462768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).