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

C9H5ClF3N3 — CID 10514665

IUPAC5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine
SMILESNc1ccc2c(Cl)cc(C(F)(F)F)nc2n1
InChIInChI=1S/C9H5ClF3N3/c10-5-3-6(9(11,12)13)15-8-4(5)1-2-7(14)16-8/h1-3H,(H2,14,15,16)
InChIKeyHDUVSZOJUPMSIX-UHFFFAOYSA-N
MW247.61 g/mol
LogP2.88
Rot. Bonds

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

5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine (PubChem CID 10514665) has the molecular formula C9H5ClF3N3 and a molecular weight of 247.61 g/mol. Its IUPAC name is 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine.

Molecular Properties

Compound Name5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine
PubChem CID10514665
Molecular FormulaC9H5ClF3N3
Molecular Weight247.61 g/mol
Exact Mass247.01
IUPAC Name5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine
SMILESNc1ccc2c(Cl)cc(C(F)(F)F)nc2n1
InChIInChI=1S/C9H5ClF3N3/c10-5-3-6(9(11,12)13)15-8-4(5)1-2-7(14)16-8/h1-3H,(H2,14,15,16)
InChIKeyHDUVSZOJUPMSIX-UHFFFAOYSA-N
XLogP2.88
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.61
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine?
The IUPAC name of 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine (CID 10514665) is 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine.
What is the SMILES notation for 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine?
The canonical SMILES for 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine is Nc1ccc2c(Cl)cc(C(F)(F)F)nc2n1.
What is the InChIKey of 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine?
The InChIKey is HDUVSZOJUPMSIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5ClF3N3/c10-5-3-6(9(11,12)13)15-8-4(5)1-2-7(14)16-8/h1-3H,(H2,14,15,16).
What are the key properties of 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine?
5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine has a molecular weight of 247.61 g/mol, XLogP of 2.88, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-7-(trifluoromethyl)-1,8-naphthyridin-2-amine is sourced from PubChem (CID 10514665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).