2,6-naphthyridine-3,7-diamine

C8H8N4 — CID 141099373

IUPAC2,6-naphthyridine-3,7-diamine
SMILESNc1cc2cnc(N)cc2cn1
InChIInChI=1S/C8H8N4/c9-7-1-5-3-12-8(10)2-6(5)4-11-7/h1-4H,(H2,9,11)(H2,10,12)
InChIKeyFASNAFRMRNPTAY-UHFFFAOYSA-N
MW160.18 g/mol
LogP0.79
Rot. Bonds

About 2,6-naphthyridine-3,7-diamine

2,6-naphthyridine-3,7-diamine (PubChem CID 141099373) has the molecular formula C8H8N4 and a molecular weight of 160.18 g/mol. Its IUPAC name is 2,6-naphthyridine-3,7-diamine.

Molecular Properties

Compound Name2,6-naphthyridine-3,7-diamine
PubChem CID141099373
Molecular FormulaC8H8N4
Molecular Weight160.18 g/mol
Exact Mass160.07
IUPAC Name2,6-naphthyridine-3,7-diamine
SMILESNc1cc2cnc(N)cc2cn1
InChIInChI=1S/C8H8N4/c9-7-1-5-3-12-8(10)2-6(5)4-11-7/h1-4H,(H2,9,11)(H2,10,12)
InChIKeyFASNAFRMRNPTAY-UHFFFAOYSA-N
XLogP0.79
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-naphthyridine-3,7-diamine?
The IUPAC name of 2,6-naphthyridine-3,7-diamine (CID 141099373) is 2,6-naphthyridine-3,7-diamine.
What is the SMILES notation for 2,6-naphthyridine-3,7-diamine?
The canonical SMILES for 2,6-naphthyridine-3,7-diamine is Nc1cc2cnc(N)cc2cn1.
What is the InChIKey of 2,6-naphthyridine-3,7-diamine?
The InChIKey is FASNAFRMRNPTAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4/c9-7-1-5-3-12-8(10)2-6(5)4-11-7/h1-4H,(H2,9,11)(H2,10,12).
What are the key properties of 2,6-naphthyridine-3,7-diamine?
2,6-naphthyridine-3,7-diamine has a molecular weight of 160.18 g/mol, XLogP of 0.79, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-naphthyridine-3,7-diamine is sourced from PubChem (CID 141099373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).