8-bromo-1,6-naphthyridin-2-amine

C8H6BrN3 — CID 58979582

IUPAC8-bromo-1,6-naphthyridin-2-amine
SMILESNc1ccc2cncc(Br)c2n1
InChIInChI=1S/C8H6BrN3/c9-6-4-11-3-5-1-2-7(10)12-8(5)6/h1-4H,(H2,10,12)
InChIKeyDSKYYPPTFGPHDE-UHFFFAOYSA-N
MW224.06 g/mol
LogP1.97
Rot. Bonds

About 8-bromo-1,6-naphthyridin-2-amine

8-bromo-1,6-naphthyridin-2-amine (PubChem CID 58979582) has the molecular formula C8H6BrN3 and a molecular weight of 224.06 g/mol. Its IUPAC name is 8-bromo-1,6-naphthyridin-2-amine.

Molecular Properties

Compound Name8-bromo-1,6-naphthyridin-2-amine
PubChem CID58979582
Molecular FormulaC8H6BrN3
Molecular Weight224.06 g/mol
Exact Mass222.97
IUPAC Name8-bromo-1,6-naphthyridin-2-amine
SMILESNc1ccc2cncc(Br)c2n1
InChIInChI=1S/C8H6BrN3/c9-6-4-11-3-5-1-2-7(10)12-8(5)6/h1-4H,(H2,10,12)
InChIKeyDSKYYPPTFGPHDE-UHFFFAOYSA-N
XLogP1.97
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.06
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-bromo-1,6-naphthyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-bromo-1,6-naphthyridin-2-amine?
The IUPAC name of 8-bromo-1,6-naphthyridin-2-amine (CID 58979582) is 8-bromo-1,6-naphthyridin-2-amine.
What is the SMILES notation for 8-bromo-1,6-naphthyridin-2-amine?
The canonical SMILES for 8-bromo-1,6-naphthyridin-2-amine is Nc1ccc2cncc(Br)c2n1.
What is the InChIKey of 8-bromo-1,6-naphthyridin-2-amine?
The InChIKey is DSKYYPPTFGPHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrN3/c9-6-4-11-3-5-1-2-7(10)12-8(5)6/h1-4H,(H2,10,12).
What are the key properties of 8-bromo-1,6-naphthyridin-2-amine?
8-bromo-1,6-naphthyridin-2-amine has a molecular weight of 224.06 g/mol, XLogP of 1.97, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-1,6-naphthyridin-2-amine is sourced from PubChem (CID 58979582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).