6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid

C14H11F4N3O3 — CID 66602035

IUPAC6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid
SMILESO=C(O)c1cc2cc(F)c(N3CCOCC3)nc2nc1C(F)(F)F
InChIInChI=1S/C14H11F4N3O3/c15-9-6-7-5-8(13(22)23)10(14(16,17)18)19-11(7)20-12(9)21-1-3-24-4-2-21/h5-6H,1-4H2,(H,22,23)
InChIKeyBMOJOBICSVIPGG-UHFFFAOYSA-N
MW345.25 g/mol
LogP2.32
Rot. Bonds2

About 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid

6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid (PubChem CID 66602035) has the molecular formula C14H11F4N3O3 and a molecular weight of 345.25 g/mol. Its IUPAC name is 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid
PubChem CID66602035
Molecular FormulaC14H11F4N3O3
Molecular Weight345.25 g/mol
Exact Mass345.07
IUPAC Name6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid
SMILESO=C(O)c1cc2cc(F)c(N3CCOCC3)nc2nc1C(F)(F)F
InChIInChI=1S/C14H11F4N3O3/c15-9-6-7-5-8(13(22)23)10(14(16,17)18)19-11(7)20-12(9)21-1-3-24-4-2-21/h5-6H,1-4H2,(H,22,23)
InChIKeyBMOJOBICSVIPGG-UHFFFAOYSA-N
XLogP2.32
TPSA75.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.25
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-fluoro-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid
CID 66601585
2-[difluoro(2-methoxyethoxy)methyl]-6-fluoro-7-methyl-1,8-naphthyridine-3-carboxylic acid
CID 66602515
3,5-difluoro-4-(1,4-oxazepan-4-yl)benzoic acid
CID 63077385
5-amino-2-morpholin-4-ylpyridine-3-carboxylic acid
CID 53213919
CID 174020982
CID 174020982
3-morpholin-4-yl-6-sulfanylidene-1H-pyridazine-4-carboxylic acid
CID 117102632
5-fluoro-N-iodo-4-morpholin-4-ylpyrimidine-2-carboxamide
CID 130197461
5-fluoro-2-methyl-6-(3-oxoazetidin-1-yl)pyridine-3-carboxylic acid
CID 172793833
(5R)-5-methyl-2-morpholin-4-yl-5,7-dihydrofuro[3,4-b]pyridine-3-carboxylic acid
CID 169247721
1-[4-morpholin-4-yl-2-(trifluoromethyl)quinazolin-6-yl]ethanone
CID 67105711
2-(4-fluorophenyl)-4-morpholin-4-ylpyrimidine-5-carboxylic acid
CID 53214965
[1-[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]piperidin-4-yl]-morpholin-4-ylmethanone
CID 165431893

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid?
The IUPAC name of 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid (CID 66602035) is 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid.
What is the SMILES notation for 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid?
The canonical SMILES for 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid is O=C(O)c1cc2cc(F)c(N3CCOCC3)nc2nc1C(F)(F)F.
What is the InChIKey of 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid?
The InChIKey is BMOJOBICSVIPGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F4N3O3/c15-9-6-7-5-8(13(22)23)10(14(16,17)18)19-11(7)20-12(9)21-1-3-24-4-2-21/h5-6H,1-4H2,(H,22,23).
What are the key properties of 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid?
6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid has a molecular weight of 345.25 g/mol, XLogP of 2.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-7-morpholin-4-yl-2-(trifluoromethyl)-1,8-naphthyridine-3-carboxylic acid is sourced from PubChem (CID 66602035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).