2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide

C17H12F3N3O3 — CID 151201417

IUPAC2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide
SMILESNC(=O)c1cc2cccnc2n(OCc2ccc(C(F)(F)F)cc2)c1=O
InChIInChI=1S/C17H12F3N3O3/c18-17(19,20)12-5-3-10(4-6-12)9-26-23-15-11(2-1-7-22-15)8-13(14(21)24)16(23)25/h1-8H,9H2,(H2,21,24)
InChIKeyNIJUDEVNJOZJAS-UHFFFAOYSA-N
MW363.30 g/mol
LogP2.14
Rot. Bonds4

About 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide

2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide (PubChem CID 151201417) has the molecular formula C17H12F3N3O3 and a molecular weight of 363.30 g/mol. Its IUPAC name is 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide
PubChem CID151201417
Molecular FormulaC17H12F3N3O3
Molecular Weight363.30 g/mol
Exact Mass363.08
IUPAC Name2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide
SMILESNC(=O)c1cc2cccnc2n(OCc2ccc(C(F)(F)F)cc2)c1=O
InChIInChI=1S/C17H12F3N3O3/c18-17(19,20)12-5-3-10(4-6-12)9-26-23-15-11(2-1-7-22-15)8-13(14(21)24)16(23)25/h1-8H,9H2,(H2,21,24)
InChIKeyNIJUDEVNJOZJAS-UHFFFAOYSA-N
XLogP2.14
TPSA87.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.30
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,2,2-trifluoroethoxy)pyrrolo[2,3-b]pyridine-2-carboxamide
CID 152717416
1-[(4-fluorophenyl)methyl]-2-oxo-N-[4-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide
CID 26844218
2-[4-(trifluoromethyl)phenoxy]pyridine-3-carboxamide
CID 175967809
4-(4-methoxyphenyl)-3-oxo-N-[[4-(trifluoromethyl)phenyl]methyl]pyrido[2,3-b]pyrazine-2-carboxamide
CID 134799263
2-oxo-N-(1,3-thiazol-2-yl)-1-[[4-(trifluoromethyl)phenyl]methoxy]pyridine-3-carboxamide
CID 110382882
1-benzyl-N-(2-carbamoylphenyl)-2-oxo-1,8-naphthyridine-3-carboxamide
CID 7620334
1-[(4-chlorophenyl)methyl]-2-oxo-N-[3-(trifluoromethyl)phenyl]-1,8-naphthyridine-3-carboxamide
CID 26844238
ethyl 2-oxo-1-phenylmethoxy-4-(trifluoromethylsulfonyloxy)-1,8-naphthyridine-3-carboxylate
CID 86639640
2-[4-(trifluoromethyl)anilino]pyridine-3-carboxamide
CID 12812716
4-(4-methyl-3-oxopyrido[2,3-b]pyrazin-2-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 46393856
3-[[4-(trifluoromethyl)phenyl]methoxy]pyridazine
CID 134106459
3-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]pyridine
CID 167152492

Frequently Asked Questions

What is the IUPAC name of 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide (CID 151201417) is 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide is NC(=O)c1cc2cccnc2n(OCc2ccc(C(F)(F)F)cc2)c1=O.
What is the InChIKey of 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide?
The InChIKey is NIJUDEVNJOZJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12F3N3O3/c18-17(19,20)12-5-3-10(4-6-12)9-26-23-15-11(2-1-7-22-15)8-13(14(21)24)16(23)25/h1-8H,9H2,(H2,21,24).
What are the key properties of 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide?
2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide has a molecular weight of 363.30 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-1-[[4-(trifluoromethyl)phenyl]methoxy]-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 151201417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).