2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide

C12H11F3N4O — CID 71451586

IUPAC2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
SMILESCCc1cc2cc(C(N)=O)c(N)nc2nc1C(F)(F)F
InChIInChI=1S/C12H11F3N4O/c1-2-5-3-6-4-7(10(17)20)9(16)19-11(6)18-8(5)12(13,14)15/h3-4H,2H2,1H3,(H2,17,20)(H2,16,18,19)
InChIKeyVEBNTTOHNAQZHY-UHFFFAOYSA-N
MW284.24 g/mol
LogP1.89
Rot. Bonds2

About 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide

2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide (PubChem CID 71451586) has the molecular formula C12H11F3N4O and a molecular weight of 284.24 g/mol. Its IUPAC name is 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
PubChem CID71451586
Molecular FormulaC12H11F3N4O
Molecular Weight284.24 g/mol
Exact Mass284.09
IUPAC Name2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
SMILESCCc1cc2cc(C(N)=O)c(N)nc2nc1C(F)(F)F
InChIInChI=1S/C12H11F3N4O/c1-2-5-3-6-4-7(10(17)20)9(16)19-11(6)18-8(5)12(13,14)15/h3-4H,2H2,1H3,(H2,17,20)(H2,16,18,19)
InChIKeyVEBNTTOHNAQZHY-UHFFFAOYSA-N
XLogP1.89
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.24
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide (CID 71451586) is 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide is CCc1cc2cc(C(N)=O)c(N)nc2nc1C(F)(F)F.
What is the InChIKey of 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The InChIKey is VEBNTTOHNAQZHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N4O/c1-2-5-3-6-4-7(10(17)20)9(16)19-11(6)18-8(5)12(13,14)15/h3-4H,2H2,1H3,(H2,17,20)(H2,16,18,19).
What are the key properties of 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide has a molecular weight of 284.24 g/mol, XLogP of 1.89, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-ethyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 71451586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).