8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one

C12H10N2O2 — CID 59651934

IUPAC8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one
SMILESO=c1cc2c(n[nH]1)CCc1cc(O)ccc1-2
InChIInChI=1S/C12H10N2O2/c15-8-2-3-9-7(5-8)1-4-11-10(9)6-12(16)14-13-11/h2-3,5-6,15H,1,4H2,(H,14,16)
InChIKeyDIPUENWCSOEQSB-UHFFFAOYSA-N
MW214.22 g/mol
LogP1.24
Rot. Bonds

About 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one

8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one (PubChem CID 59651934) has the molecular formula C12H10N2O2 and a molecular weight of 214.22 g/mol. Its IUPAC name is 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one.

Molecular Properties

Compound Name8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one
PubChem CID59651934
Molecular FormulaC12H10N2O2
Molecular Weight214.22 g/mol
Exact Mass214.07
IUPAC Name8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one
SMILESO=c1cc2c(n[nH]1)CCc1cc(O)ccc1-2
InChIInChI=1S/C12H10N2O2/c15-8-2-3-9-7(5-8)1-4-11-10(9)6-12(16)14-13-11/h2-3,5-6,15H,1,4H2,(H,14,16)
InChIKeyDIPUENWCSOEQSB-UHFFFAOYSA-N
XLogP1.24
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one?
The IUPAC name of 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one (CID 59651934) is 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one.
What is the SMILES notation for 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one?
The canonical SMILES for 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one is O=c1cc2c(n[nH]1)CCc1cc(O)ccc1-2.
What is the InChIKey of 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one?
The InChIKey is DIPUENWCSOEQSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O2/c15-8-2-3-9-7(5-8)1-4-11-10(9)6-12(16)14-13-11/h2-3,5-6,15H,1,4H2,(H,14,16).
What are the key properties of 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one?
8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one has a molecular weight of 214.22 g/mol, XLogP of 1.24, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-5,6-dihydro-3H-benzo[f]cinnolin-2-one is sourced from PubChem (CID 59651934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).