imidazo[4,5-g]phthalazin-2-one

C9H4N4O — CID 154390659

IUPACimidazo[4,5-g]phthalazin-2-one
SMILESO=C1N=c2cc3cnncc3cc2=N1
InChIInChI=1S/C9H4N4O/c14-9-12-7-1-5-3-10-11-4-6(5)2-8(7)13-9/h1-4H
InChIKeyGWFAKDJLMBUQAN-UHFFFAOYSA-N
MW184.16 g/mol
LogP0.00
Rot. Bonds

About imidazo[4,5-g]phthalazin-2-one

imidazo[4,5-g]phthalazin-2-one (PubChem CID 154390659) has the molecular formula C9H4N4O and a molecular weight of 184.16 g/mol. Its IUPAC name is imidazo[4,5-g]phthalazin-2-one.

Molecular Properties

Compound Nameimidazo[4,5-g]phthalazin-2-one
PubChem CID154390659
Molecular FormulaC9H4N4O
Molecular Weight184.16 g/mol
Exact Mass184.04
IUPAC Nameimidazo[4,5-g]phthalazin-2-one
SMILESO=C1N=c2cc3cnncc3cc2=N1
InChIInChI=1S/C9H4N4O/c14-9-12-7-1-5-3-10-11-4-6(5)2-8(7)13-9/h1-4H
InChIKeyGWFAKDJLMBUQAN-UHFFFAOYSA-N
XLogP0.00
TPSA67.57 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 50.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of imidazo[4,5-g]phthalazin-2-one?
The IUPAC name of imidazo[4,5-g]phthalazin-2-one (CID 154390659) is imidazo[4,5-g]phthalazin-2-one.
What is the SMILES notation for imidazo[4,5-g]phthalazin-2-one?
The canonical SMILES for imidazo[4,5-g]phthalazin-2-one is O=C1N=c2cc3cnncc3cc2=N1.
What is the InChIKey of imidazo[4,5-g]phthalazin-2-one?
The InChIKey is GWFAKDJLMBUQAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H4N4O/c14-9-12-7-1-5-3-10-11-4-6(5)2-8(7)13-9/h1-4H.
What are the key properties of imidazo[4,5-g]phthalazin-2-one?
imidazo[4,5-g]phthalazin-2-one has a molecular weight of 184.16 g/mol, XLogP of 0.00, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[4,5-g]phthalazin-2-one is sourced from PubChem (CID 154390659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).