8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one

C14H9N5O — CID 147279802

IUPAC8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one
SMILESO=c1[nH]c2cc(C3=NN=NC3)ccc2c2cnccc12
InChIInChI=1S/C14H9N5O/c20-14-10-3-4-15-6-11(10)9-2-1-8(5-12(9)17-14)13-7-16-19-18-13/h1-6H,7H2,(H,17,20)
InChIKeyCSBOWVFHEBVCLX-UHFFFAOYSA-N
MW263.26 g/mol
LogP2.25
Rot. Bonds1

About 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one

8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one (PubChem CID 147279802) has the molecular formula C14H9N5O and a molecular weight of 263.26 g/mol. Its IUPAC name is 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one.

Molecular Properties

Compound Name8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one
PubChem CID147279802
Molecular FormulaC14H9N5O
Molecular Weight263.26 g/mol
Exact Mass263.08
IUPAC Name8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one
SMILESO=c1[nH]c2cc(C3=NN=NC3)ccc2c2cnccc12
InChIInChI=1S/C14H9N5O/c20-14-10-3-4-15-6-11(10)9-2-1-8(5-12(9)17-14)13-7-16-19-18-13/h1-6H,7H2,(H,17,20)
InChIKeyCSBOWVFHEBVCLX-UHFFFAOYSA-N
XLogP2.25
TPSA82.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.26
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-fluoro-9-oxo-N-[2-(pyridin-3-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748022
9-oxo-N-[2-(pyridin-3-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748020
2-fluoro-9-oxo-N-[2-(pyridin-2-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748525
9-oxo-N-[2-(pyridin-4-yl)propan-2-yl]-9,10-dihydroacridine-3-carboxamide
CID 16748637
benzo[c][1,5]naphthyridin-6(5H)-one
CID 10535869
6-(Pyridin-3-yl)-3,4-dihydroquinolin-2(1H)-one
CID 13728862
3-aminobenzo[c][1,5]naphthyridin-6(5H)-one
CID 16221809
2-fluoro-N-[2-(6-methylpyridin-3-yl)propan-2-yl]-9-oxo-9,10-dihydroacridine-3-carboxamide
CID 16748144
N-(quinolin-6-yl)benzamide
CID 833617
4-methyl-N-quinolin-6-ylbenzamide
CID 1506500
4-tert-butyl-N-[3-(N-isonicotinoylethanehydrazonoyl)phenyl]benzamide
CID 9563889
5H-Benzo[c][1,6]naphthyridin-6-one
CID 15488572

Frequently Asked Questions

What is the IUPAC name of 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one?
The IUPAC name of 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one (CID 147279802) is 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one.
What is the SMILES notation for 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one?
The canonical SMILES for 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one is O=c1[nH]c2cc(C3=NN=NC3)ccc2c2cnccc12.
What is the InChIKey of 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one?
The InChIKey is CSBOWVFHEBVCLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9N5O/c20-14-10-3-4-15-6-11(10)9-2-1-8(5-12(9)17-14)13-7-16-19-18-13/h1-6H,7H2,(H,17,20).
What are the key properties of 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one?
8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one has a molecular weight of 263.26 g/mol, XLogP of 2.25, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4H-triazol-5-yl)-6H-benzo[c][2,6]naphthyridin-5-one is sourced from PubChem (CID 147279802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).