1,5-naphthyridine-3,4-diamine

C8H8N4 — CID 22172703

IUPAC1,5-naphthyridine-3,4-diamine
SMILESNc1cnc2cccnc2c1N
InChIInChI=1S/C8H8N4/c9-5-4-12-6-2-1-3-11-8(6)7(5)10/h1-4H,9H2,(H2,10,12)
InChIKeyMIDQVYLLSDOPIL-UHFFFAOYSA-N
MW160.18 g/mol
LogP0.79
Rot. Bonds

About 1,5-naphthyridine-3,4-diamine

1,5-naphthyridine-3,4-diamine (PubChem CID 22172703) has the molecular formula C8H8N4 and a molecular weight of 160.18 g/mol. Its IUPAC name is 1,5-naphthyridine-3,4-diamine.

Molecular Properties

Compound Name1,5-naphthyridine-3,4-diamine
PubChem CID22172703
Molecular FormulaC8H8N4
Molecular Weight160.18 g/mol
Exact Mass160.07
IUPAC Name1,5-naphthyridine-3,4-diamine
SMILESNc1cnc2cccnc2c1N
InChIInChI=1S/C8H8N4/c9-5-4-12-6-2-1-3-11-8(6)7(5)10/h1-4H,9H2,(H2,10,12)
InChIKeyMIDQVYLLSDOPIL-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

Analyze 1,5-naphthyridine-3,4-diamine 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 1,5-naphthyridine-3,4-diamine?
The IUPAC name of 1,5-naphthyridine-3,4-diamine (CID 22172703) is 1,5-naphthyridine-3,4-diamine.
What is the SMILES notation for 1,5-naphthyridine-3,4-diamine?
The canonical SMILES for 1,5-naphthyridine-3,4-diamine is Nc1cnc2cccnc2c1N.
What is the InChIKey of 1,5-naphthyridine-3,4-diamine?
The InChIKey is MIDQVYLLSDOPIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4/c9-5-4-12-6-2-1-3-11-8(6)7(5)10/h1-4H,9H2,(H2,10,12).
What are the key properties of 1,5-naphthyridine-3,4-diamine?
1,5-naphthyridine-3,4-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 1,5-naphthyridine-3,4-diamine is sourced from PubChem (CID 22172703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).