N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine

C20H13FN6 — CID 57395548

IUPACN-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine
SMILESFc1cccc(Nc2nc3c(-c4ncn[nH]4)cccc3c3cnccc23)c1
InChIInChI=1S/C20H13FN6/c21-12-3-1-4-13(9-12)25-20-15-7-8-22-10-17(15)14-5-2-6-16(18(14)26-20)19-23-11-24-27-19/h1-11H,(H,25,26)(H,23,24,27)
InChIKeyAZWJVNNXHBOAKD-UHFFFAOYSA-N
MW356.36 g/mol
LogP4.45
Rot. Bonds3

About N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine

N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine (PubChem CID 57395548) has the molecular formula C20H13FN6 and a molecular weight of 356.36 g/mol. Its IUPAC name is N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine
PubChem CID57395548
Molecular FormulaC20H13FN6
Molecular Weight356.36 g/mol
Exact Mass356.12
IUPAC NameN-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine
SMILESFc1cccc(Nc2nc3c(-c4ncn[nH]4)cccc3c3cnccc23)c1
InChIInChI=1S/C20H13FN6/c21-12-3-1-4-13(9-12)25-20-15-7-8-22-10-17(15)14-5-2-6-16(18(14)26-20)19-23-11-24-27-19/h1-11H,(H,25,26)(H,23,24,27)
InChIKeyAZWJVNNXHBOAKD-UHFFFAOYSA-N
XLogP4.45
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.36
LogP ≤ 54.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine 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

4-(6-(4-(1-Piperazinyl)phenyl)pyrazolo(1,5-a)pyrimidin-3-yl)quinoline
CID 25195294
Benzo[c]-2,6-naphthyridin-5-amine, N-(2-chlorophenyl)-7-(1H-1,2,4-triazol-5-yl)-
CID 44222958
1-(1-methylethyl)-3-quinolin-6-yl-1H-pyrazolo(3,4-d)pyrimidin-4-amine
CID 24905152
Vlx-600
CID 6410104
N-(3,4-difluorophenyl)-2-pyridin-4-ylquinazolin-4-amine
CID 921541
6-[Difluoro-[6-(4-fluorophenyl)-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]methyl]quinoline
CID 127045762
2-phenyl-N-(pyridin-4-yl)quinazolin-4-amine
CID 6456587
N-methyl-6-phenyl-7-[4-({4-[5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl]piperidin-1-yl}methyl)phenyl]pyrido[2,3-d]pyrimidin-2-amine
CID 11664023
Aminoquinazoline, 19
CID 24863072
6-(1H-pyrazolo[3,4-b]pyridin-5-yl)-4-pyridin-4-ylquinoline
CID 46174165
VU2957
CID 134191471
4-[1-(5,8-difluoroquinolin-4-yl)-2-methyl-4-(4H-1,2,4-triazol-3-yl)-1H-benzimidazol-6-yl]-3-fluoropyridin-2-amine
CID 134372959

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine?
The IUPAC name of N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine (CID 57395548) is N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine.
What is the SMILES notation for N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine?
The canonical SMILES for N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine is Fc1cccc(Nc2nc3c(-c4ncn[nH]4)cccc3c3cnccc23)c1.
What is the InChIKey of N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine?
The InChIKey is AZWJVNNXHBOAKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13FN6/c21-12-3-1-4-13(9-12)25-20-15-7-8-22-10-17(15)14-5-2-6-16(18(14)26-20)19-23-11-24-27-19/h1-11H,(H,25,26)(H,23,24,27).
What are the key properties of N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine?
N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine has a molecular weight of 356.36 g/mol, XLogP of 4.45, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-7-(1H-1,2,4-triazol-5-yl)benzo[c][2,6]naphthyridin-5-amine is sourced from PubChem (CID 57395548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).