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

C13H11F3N4O — CID 71458769

IUPAC2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
SMILESNC(=O)c1cc2cc(C3CC3)c(C(F)(F)F)nc2nc1N
InChIInChI=1S/C13H11F3N4O/c14-13(15,16)9-7(5-1-2-5)3-6-4-8(11(18)21)10(17)20-12(6)19-9/h3-5H,1-2H2,(H2,18,21)(H2,17,19,20)
InChIKeyJFRIRYJINQESAV-UHFFFAOYSA-N
MW296.25 g/mol
LogP2.21
Rot. Bonds2

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

2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide (PubChem CID 71458769) has the molecular formula C13H11F3N4O and a molecular weight of 296.25 g/mol. Its IUPAC name is 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
PubChem CID71458769
Molecular FormulaC13H11F3N4O
Molecular Weight296.25 g/mol
Exact Mass296.09
IUPAC Name2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide
SMILESNC(=O)c1cc2cc(C3CC3)c(C(F)(F)F)nc2nc1N
InChIInChI=1S/C13H11F3N4O/c14-13(15,16)9-7(5-1-2-5)3-6-4-8(11(18)21)10(17)20-12(6)19-9/h3-5H,1-2H2,(H2,18,21)(H2,17,19,20)
InChIKeyJFRIRYJINQESAV-UHFFFAOYSA-N
XLogP2.21
TPSA94.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.25
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The IUPAC name of 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide (CID 71458769) is 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide.
What is the SMILES notation for 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The canonical SMILES for 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide is NC(=O)c1cc2cc(C3CC3)c(C(F)(F)F)nc2nc1N.
What is the InChIKey of 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
The InChIKey is JFRIRYJINQESAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3N4O/c14-13(15,16)9-7(5-1-2-5)3-6-4-8(11(18)21)10(17)20-12(6)19-9/h3-5H,1-2H2,(H2,18,21)(H2,17,19,20).
What are the key properties of 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide?
2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide has a molecular weight of 296.25 g/mol, XLogP of 2.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-cyclopropyl-7-(trifluoromethyl)-1,8-naphthyridine-3-carboxamide is sourced from PubChem (CID 71458769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).