7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid

C10H5F3N2O2 — CID 11630097

IUPAC7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2ccc(C(F)(F)F)nc2n1
InChIInChI=1S/C10H5F3N2O2/c11-10(12,13)7-4-2-5-1-3-6(9(16)17)14-8(5)15-7/h1-4H,(H,16,17)
InChIKeyQCBVRXCAMDXXTO-UHFFFAOYSA-N
MW242.16 g/mol
LogP2.35
Rot. Bonds1

About 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid

7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid (PubChem CID 11630097) has the molecular formula C10H5F3N2O2 and a molecular weight of 242.16 g/mol. Its IUPAC name is 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid.

Molecular Properties

Compound Name7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid
PubChem CID11630097
Molecular FormulaC10H5F3N2O2
Molecular Weight242.16 g/mol
Exact Mass242.03
IUPAC Name7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid
SMILESO=C(O)c1ccc2ccc(C(F)(F)F)nc2n1
InChIInChI=1S/C10H5F3N2O2/c11-10(12,13)7-4-2-5-1-3-6(9(16)17)14-8(5)15-7/h1-4H,(H,16,17)
InChIKeyQCBVRXCAMDXXTO-UHFFFAOYSA-N
XLogP2.35
TPSA63.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.16
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid?
The IUPAC name of 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid (CID 11630097) is 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid.
What is the SMILES notation for 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid?
The canonical SMILES for 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid is O=C(O)c1ccc2ccc(C(F)(F)F)nc2n1.
What is the InChIKey of 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid?
The InChIKey is QCBVRXCAMDXXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5F3N2O2/c11-10(12,13)7-4-2-5-1-3-6(9(16)17)14-8(5)15-7/h1-4H,(H,16,17).
What are the key properties of 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid?
7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid has a molecular weight of 242.16 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)-1,8-naphthyridine-2-carboxylic acid is sourced from PubChem (CID 11630097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).