1,8a-dihydro-1,8-naphthyridine

C8H8N2 — CID 18988805

IUPAC1,8a-dihydro-1,8-naphthyridine
SMILESC1=CNC2N=CC=CC2=C1
InChIInChI=1S/C8H8N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-6,8-9H
InChIKeyQJGCZNTUPNIRRQ-UHFFFAOYSA-N
MW132.17 g/mol
LogP1.00
Rot. Bonds

About 1,8a-dihydro-1,8-naphthyridine

1,8a-dihydro-1,8-naphthyridine (PubChem CID 18988805) has the molecular formula C8H8N2 and a molecular weight of 132.17 g/mol. Its IUPAC name is 1,8a-dihydro-1,8-naphthyridine.

Molecular Properties

Compound Name1,8a-dihydro-1,8-naphthyridine
PubChem CID18988805
Molecular FormulaC8H8N2
Molecular Weight132.17 g/mol
Exact Mass132.07
IUPAC Name1,8a-dihydro-1,8-naphthyridine
SMILESC1=CNC2N=CC=CC2=C1
InChIInChI=1S/C8H8N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-6,8-9H
InChIKeyQJGCZNTUPNIRRQ-UHFFFAOYSA-N
XLogP1.00
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,8a-dihydro-1,8-naphthyridine?
The IUPAC name of 1,8a-dihydro-1,8-naphthyridine (CID 18988805) is 1,8a-dihydro-1,8-naphthyridine.
What is the SMILES notation for 1,8a-dihydro-1,8-naphthyridine?
The canonical SMILES for 1,8a-dihydro-1,8-naphthyridine is C1=CNC2N=CC=CC2=C1.
What is the InChIKey of 1,8a-dihydro-1,8-naphthyridine?
The InChIKey is QJGCZNTUPNIRRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-6,8-9H.
What are the key properties of 1,8a-dihydro-1,8-naphthyridine?
1,8a-dihydro-1,8-naphthyridine has a molecular weight of 132.17 g/mol, XLogP of 1.00, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8a-dihydro-1,8-naphthyridine is sourced from PubChem (CID 18988805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).