5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine

C10H5F6N3 — CID 2783071

IUPAC5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine
SMILESNc1ccc2c(C(F)(F)F)cc(C(F)(F)F)nc2n1
InChIInChI=1S/C10H5F6N3/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(17)19-8/h1-3H,(H2,17,18,19)
InChIKeyCLSSRJKZGCCBKL-UHFFFAOYSA-N
MW281.16 g/mol
LogP3.25
Rot. Bonds

About 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine

5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine (PubChem CID 2783071) has the molecular formula C10H5F6N3 and a molecular weight of 281.16 g/mol. Its IUPAC name is 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine.

Molecular Properties

Compound Name5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine
PubChem CID2783071
Molecular FormulaC10H5F6N3
Molecular Weight281.16 g/mol
Exact Mass281.04
IUPAC Name5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine
SMILESNc1ccc2c(C(F)(F)F)cc(C(F)(F)F)nc2n1
InChIInChI=1S/C10H5F6N3/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(17)19-8/h1-3H,(H2,17,18,19)
InChIKeyCLSSRJKZGCCBKL-UHFFFAOYSA-N
XLogP3.25
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.16
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine?
The IUPAC name of 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine (CID 2783071) is 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine.
What is the SMILES notation for 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine?
The canonical SMILES for 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine is Nc1ccc2c(C(F)(F)F)cc(C(F)(F)F)nc2n1.
What is the InChIKey of 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine?
The InChIKey is CLSSRJKZGCCBKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5F6N3/c11-9(12,13)5-3-6(10(14,15)16)18-8-4(5)1-2-7(17)19-8/h1-3H,(H2,17,18,19).
What are the key properties of 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine?
5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine has a molecular weight of 281.16 g/mol, XLogP of 3.25, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-bis(trifluoromethyl)-1,8-naphthyridin-2-amine is sourced from PubChem (CID 2783071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).