6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine

C18H10F3N3 — CID 162534915

IUPAC6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine
SMILESFC(F)(F)c1ccc(-c2nc3ncccc3c3cccnc23)cc1
InChIInChI=1S/C18H10F3N3/c19-18(20,21)12-7-5-11(6-8-12)15-16-13(3-1-9-22-16)14-4-2-10-23-17(14)24-15/h1-10H
InChIKeyNEICOHAHJJOJRK-UHFFFAOYSA-N
MW325.29 g/mol
LogP4.86
Rot. Bonds1

About 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine

6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine (PubChem CID 162534915) has the molecular formula C18H10F3N3 and a molecular weight of 325.29 g/mol. Its IUPAC name is 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine.

Molecular Properties

Compound Name6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine
PubChem CID162534915
Molecular FormulaC18H10F3N3
Molecular Weight325.29 g/mol
Exact Mass325.08
IUPAC Name6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine
SMILESFC(F)(F)c1ccc(-c2nc3ncccc3c3cccnc23)cc1
InChIInChI=1S/C18H10F3N3/c19-18(20,21)12-7-5-11(6-8-12)15-16-13(3-1-9-22-16)14-4-2-10-23-17(14)24-15/h1-10H
InChIKeyNEICOHAHJJOJRK-UHFFFAOYSA-N
XLogP4.86
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.29
LogP ≤ 54.86
H-Bond Donors ≤ 50
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 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine?
The IUPAC name of 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine (CID 162534915) is 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine.
What is the SMILES notation for 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine?
The canonical SMILES for 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine is FC(F)(F)c1ccc(-c2nc3ncccc3c3cccnc23)cc1.
What is the InChIKey of 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine?
The InChIKey is NEICOHAHJJOJRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10F3N3/c19-18(20,21)12-7-5-11(6-8-12)15-16-13(3-1-9-22-16)14-4-2-10-23-17(14)24-15/h1-10H.
What are the key properties of 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine?
6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine has a molecular weight of 325.29 g/mol, XLogP of 4.86, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(trifluoromethyl)phenyl]pyrido[2,3-c][1,8]naphthyridine is sourced from PubChem (CID 162534915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).