3,4-dihydro-1H-1,6-naphthyridin-2-one

C8H8N2O — CID 18952402

IUPAC3,4-dihydro-1H-1,6-naphthyridin-2-one
SMILESO=C1CCc2cnccc2N1
InChIInChI=1S/C8H8N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h3-5H,1-2H2,(H,10,11)
InChIKeyKLPUJWLQGMDXDV-UHFFFAOYSA-N
MW148.16 g/mol
LogP0.97
Rot. Bonds

About 3,4-dihydro-1H-1,6-naphthyridin-2-one

3,4-dihydro-1H-1,6-naphthyridin-2-one (PubChem CID 18952402) has the molecular formula C8H8N2O and a molecular weight of 148.16 g/mol. Its IUPAC name is 3,4-dihydro-1H-1,6-naphthyridin-2-one.

Molecular Properties

Compound Name3,4-dihydro-1H-1,6-naphthyridin-2-one
PubChem CID18952402
Molecular FormulaC8H8N2O
Molecular Weight148.16 g/mol
Exact Mass148.06
IUPAC Name3,4-dihydro-1H-1,6-naphthyridin-2-one
SMILESO=C1CCc2cnccc2N1
InChIInChI=1S/C8H8N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h3-5H,1-2H2,(H,10,11)
InChIKeyKLPUJWLQGMDXDV-UHFFFAOYSA-N
XLogP0.97
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-1H-1,6-naphthyridin-2-one?
The IUPAC name of 3,4-dihydro-1H-1,6-naphthyridin-2-one (CID 18952402) is 3,4-dihydro-1H-1,6-naphthyridin-2-one.
What is the SMILES notation for 3,4-dihydro-1H-1,6-naphthyridin-2-one?
The canonical SMILES for 3,4-dihydro-1H-1,6-naphthyridin-2-one is O=C1CCc2cnccc2N1.
What is the InChIKey of 3,4-dihydro-1H-1,6-naphthyridin-2-one?
The InChIKey is KLPUJWLQGMDXDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O/c11-8-2-1-6-5-9-4-3-7(6)10-8/h3-5H,1-2H2,(H,10,11).
What are the key properties of 3,4-dihydro-1H-1,6-naphthyridin-2-one?
3,4-dihydro-1H-1,6-naphthyridin-2-one has a molecular weight of 148.16 g/mol, XLogP of 0.97, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-1H-1,6-naphthyridin-2-one is sourced from PubChem (CID 18952402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).