imidazo[4,5-h]isoquinolin-9-one

C10H5N3O — CID 90904928

IUPACimidazo[4,5-h]isoquinolin-9-one
SMILESO=C1N=CC=c2ccc3c(c21)N=CN=3
InChIInChI=1S/C10H5N3O/c14-10-8-6(3-4-11-10)1-2-7-9(8)13-5-12-7/h1-5H
InChIKeyQQTAJIAHTYPYLE-UHFFFAOYSA-N
MW183.17 g/mol
LogP-0.02
Rot. Bonds

About imidazo[4,5-h]isoquinolin-9-one

imidazo[4,5-h]isoquinolin-9-one (PubChem CID 90904928) has the molecular formula C10H5N3O and a molecular weight of 183.17 g/mol. Its IUPAC name is imidazo[4,5-h]isoquinolin-9-one.

Molecular Properties

Compound Nameimidazo[4,5-h]isoquinolin-9-one
PubChem CID90904928
Molecular FormulaC10H5N3O
Molecular Weight183.17 g/mol
Exact Mass183.04
IUPAC Nameimidazo[4,5-h]isoquinolin-9-one
SMILESO=C1N=CC=c2ccc3c(c21)N=CN=3
InChIInChI=1S/C10H5N3O/c14-10-8-6(3-4-11-10)1-2-7-9(8)13-5-12-7/h1-5H
InChIKeyQQTAJIAHTYPYLE-UHFFFAOYSA-N
XLogP-0.02
TPSA54.15 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.17
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Pyrrolo(3,2-c)quinolin-4-one
CID 88316851
Pyrroloisoquinolone
CID 69399635
Isoindolopyrimidone
CID 129796580
Pyrrolonaphthyridinone
CID 132277487
Triazinoisoindolone
CID 129708815
Pyrazolo[4,3-f]quinazolin-9-one
CID 129732351
Imidazocinnolinone
CID 129745290
Pyrrolo[2,3-g]quinolone
CID 129782230
Pyrrolo[3,2-g]quinolin-7-one
CID 132275779
4,10-Diazatricyclo[7.4.0.02,7]trideca-1,4,6,8,10,12-hexaen-3-one
CID 19874670
Imidazo[4,5-g]quinolin-6-one
CID 19896762
Benzimidazolo[4,5-f]isoquinolin-8-one
CID 22574155

Frequently Asked Questions

What is the IUPAC name of imidazo[4,5-h]isoquinolin-9-one?
The IUPAC name of imidazo[4,5-h]isoquinolin-9-one (CID 90904928) is imidazo[4,5-h]isoquinolin-9-one.
What is the SMILES notation for imidazo[4,5-h]isoquinolin-9-one?
The canonical SMILES for imidazo[4,5-h]isoquinolin-9-one is O=C1N=CC=c2ccc3c(c21)N=CN=3.
What is the InChIKey of imidazo[4,5-h]isoquinolin-9-one?
The InChIKey is QQTAJIAHTYPYLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5N3O/c14-10-8-6(3-4-11-10)1-2-7-9(8)13-5-12-7/h1-5H.
What are the key properties of imidazo[4,5-h]isoquinolin-9-one?
imidazo[4,5-h]isoquinolin-9-one has a molecular weight of 183.17 g/mol, XLogP of -0.02, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[4,5-h]isoquinolin-9-one is sourced from PubChem (CID 90904928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).