4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine

C11H9F3N2O — CID 70329519

IUPAC4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine
SMILESCOc1cc(C(F)(F)F)nc2nc(C)ccc12
InChIInChI=1S/C11H9F3N2O/c1-6-3-4-7-8(17-2)5-9(11(12,13)14)16-10(7)15-6/h3-5H,1-2H3
InChIKeyZLRPZQYEWQTVSQ-UHFFFAOYSA-N
MW242.20 g/mol
LogP2.97
Rot. Bonds1

About 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine

4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine (PubChem CID 70329519) has the molecular formula C11H9F3N2O and a molecular weight of 242.20 g/mol. Its IUPAC name is 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine.

Molecular Properties

Compound Name4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine
PubChem CID70329519
Molecular FormulaC11H9F3N2O
Molecular Weight242.20 g/mol
Exact Mass242.07
IUPAC Name4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine
SMILESCOc1cc(C(F)(F)F)nc2nc(C)ccc12
InChIInChI=1S/C11H9F3N2O/c1-6-3-4-7-8(17-2)5-9(11(12,13)14)16-10(7)15-6/h3-5H,1-2H3
InChIKeyZLRPZQYEWQTVSQ-UHFFFAOYSA-N
XLogP2.97
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine?
The IUPAC name of 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine (CID 70329519) is 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine.
What is the SMILES notation for 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine?
The canonical SMILES for 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine is COc1cc(C(F)(F)F)nc2nc(C)ccc12.
What is the InChIKey of 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine?
The InChIKey is ZLRPZQYEWQTVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2O/c1-6-3-4-7-8(17-2)5-9(11(12,13)14)16-10(7)15-6/h3-5H,1-2H3.
What are the key properties of 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine?
4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine has a molecular weight of 242.20 g/mol, XLogP of 2.97, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-7-methyl-2-(trifluoromethyl)-1,8-naphthyridine is sourced from PubChem (CID 70329519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).