6,7-dimethoxyphthalazine

C10H10N2O2 — CID 6415616

IUPAC6,7-dimethoxyphthalazine
SMILESCOc1cc2cnncc2cc1OC
InChIInChI=1S/C10H10N2O2/c1-13-9-3-7-5-11-12-6-8(7)4-10(9)14-2/h3-6H,1-2H3
InChIKeyKRZOYZJHHSOERZ-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.65
Rot. Bonds2

About 6,7-dimethoxyphthalazine

6,7-dimethoxyphthalazine (PubChem CID 6415616) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 6,7-dimethoxyphthalazine.

Molecular Properties

Compound Name6,7-dimethoxyphthalazine
PubChem CID6415616
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name6,7-dimethoxyphthalazine
SMILESCOc1cc2cnncc2cc1OC
InChIInChI=1S/C10H10N2O2/c1-13-9-3-7-5-11-12-6-8(7)4-10(9)14-2/h3-6H,1-2H3
InChIKeyKRZOYZJHHSOERZ-UHFFFAOYSA-N
XLogP1.65
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxyphthalazine?
The IUPAC name of 6,7-dimethoxyphthalazine (CID 6415616) is 6,7-dimethoxyphthalazine.
What is the SMILES notation for 6,7-dimethoxyphthalazine?
The canonical SMILES for 6,7-dimethoxyphthalazine is COc1cc2cnncc2cc1OC.
What is the InChIKey of 6,7-dimethoxyphthalazine?
The InChIKey is KRZOYZJHHSOERZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-13-9-3-7-5-11-12-6-8(7)4-10(9)14-2/h3-6H,1-2H3.
What are the key properties of 6,7-dimethoxyphthalazine?
6,7-dimethoxyphthalazine has a molecular weight of 190.20 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxyphthalazine is sourced from PubChem (CID 6415616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).