Ethyl 2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate

HCID 53471985

Basic information

CAS
794461-86-2
Standard SMILES
CCOC(=O)c1cc2c(nc1C(F)(F)F)CNCC2
InChIKey
HQUITAKYLCSYBG-UHFFFAOYSA-N
Molecular formula
C12H13F3N2O2
Average molar mass
274.24 g/mol
Monoisotopic mass
274.09291232

Names & identifiers

Preferred name
Ethyl 2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate
IUPAC
ethyl 2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylate
English name
2-Trifluoromethyl-5,6,7,8-tetrahydro-[1,7]naphthyridine-3-carboxylic acid ethyl ester
Molecular weight
0

Names & synonyms

794461-86-2ethyl 2-(trifluoromethyl)-5,6,7,8-tetrahydro-1,7-naphthyridine-3-carboxylateSCHEMBL4791549DTXSID50703812HQUITAKYLCSYBG-UHFFFAOYSA-N2-Trifluoromethyl-5,6,7,8-tetrahydro-[1,7]naphthyridine-3-carboxylic acid ethyl ester

Database identifiers

CAS
794461-86-2
PubChem CID
53471985
DTXSID
DTXSID50703812

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
51.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
3
Heavy atoms
19

Chemistry & industry

Suppliers1 total

Related reactions

2 records

Compound notes

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