7,8-dihydrobenzo[b][1,5]naphthyridine

C12H10N2 — CID 130290940

IUPAC7,8-dihydrobenzo[b][1,5]naphthyridine
SMILESC1=c2cc3ncccc3nc2=CCC1
InChIInChI=1S/C12H10N2/c1-2-5-10-9(4-1)8-12-11(14-10)6-3-7-13-12/h3-8H,1-2H2
InChIKeyGUZLPCMEWCLJSL-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.98
Rot. Bonds

About 7,8-dihydrobenzo[b][1,5]naphthyridine

7,8-dihydrobenzo[b][1,5]naphthyridine (PubChem CID 130290940) has the molecular formula C12H10N2 and a molecular weight of 182.23 g/mol. Its IUPAC name is 7,8-dihydrobenzo[b][1,5]naphthyridine.

Molecular Properties

Compound Name7,8-dihydrobenzo[b][1,5]naphthyridine
PubChem CID130290940
Molecular FormulaC12H10N2
Molecular Weight182.23 g/mol
Exact Mass182.08
IUPAC Name7,8-dihydrobenzo[b][1,5]naphthyridine
SMILESC1=c2cc3ncccc3nc2=CCC1
InChIInChI=1S/C12H10N2/c1-2-5-10-9(4-1)8-12-11(14-10)6-3-7-13-12/h3-8H,1-2H2
InChIKeyGUZLPCMEWCLJSL-UHFFFAOYSA-N
XLogP0.98
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7,8-dihydrobenzo[b][1,5]naphthyridine?
The IUPAC name of 7,8-dihydrobenzo[b][1,5]naphthyridine (CID 130290940) is 7,8-dihydrobenzo[b][1,5]naphthyridine.
What is the SMILES notation for 7,8-dihydrobenzo[b][1,5]naphthyridine?
The canonical SMILES for 7,8-dihydrobenzo[b][1,5]naphthyridine is C1=c2cc3ncccc3nc2=CCC1.
What is the InChIKey of 7,8-dihydrobenzo[b][1,5]naphthyridine?
The InChIKey is GUZLPCMEWCLJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2/c1-2-5-10-9(4-1)8-12-11(14-10)6-3-7-13-12/h3-8H,1-2H2.
What are the key properties of 7,8-dihydrobenzo[b][1,5]naphthyridine?
7,8-dihydrobenzo[b][1,5]naphthyridine has a molecular weight of 182.23 g/mol, XLogP of 0.98, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydrobenzo[b][1,5]naphthyridine is sourced from PubChem (CID 130290940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).