imidazo[4,5-g][1,2]benzodiazepine

C10H6N4 — CID 67657169

IUPACimidazo[4,5-g][1,2]benzodiazepine
SMILESc1cnnc2ccc3ncnc3c2c1
InChIInChI=1S/C10H6N4/c1-2-7-8(14-13-5-1)3-4-9-10(7)12-6-11-9/h1-6H
InChIKeyUWRXTZSXCFXJTR-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.57
Rot. Bonds

About imidazo[4,5-g][1,2]benzodiazepine

imidazo[4,5-g][1,2]benzodiazepine (PubChem CID 67657169) has the molecular formula C10H6N4 and a molecular weight of 182.19 g/mol. Its IUPAC name is imidazo[4,5-g][1,2]benzodiazepine.

Molecular Properties

Compound Nameimidazo[4,5-g][1,2]benzodiazepine
PubChem CID67657169
Molecular FormulaC10H6N4
Molecular Weight182.19 g/mol
Exact Mass182.06
IUPAC Nameimidazo[4,5-g][1,2]benzodiazepine
SMILESc1cnnc2ccc3ncnc3c2c1
InChIInChI=1S/C10H6N4/c1-2-7-8(14-13-5-1)3-4-9-10(7)12-6-11-9/h1-6H
InChIKeyUWRXTZSXCFXJTR-UHFFFAOYSA-N
XLogP1.57
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of imidazo[4,5-g][1,2]benzodiazepine?
The IUPAC name of imidazo[4,5-g][1,2]benzodiazepine (CID 67657169) is imidazo[4,5-g][1,2]benzodiazepine.
What is the SMILES notation for imidazo[4,5-g][1,2]benzodiazepine?
The canonical SMILES for imidazo[4,5-g][1,2]benzodiazepine is c1cnnc2ccc3ncnc3c2c1.
What is the InChIKey of imidazo[4,5-g][1,2]benzodiazepine?
The InChIKey is UWRXTZSXCFXJTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N4/c1-2-7-8(14-13-5-1)3-4-9-10(7)12-6-11-9/h1-6H.
What are the key properties of imidazo[4,5-g][1,2]benzodiazepine?
imidazo[4,5-g][1,2]benzodiazepine has a molecular weight of 182.19 g/mol, XLogP of 1.57, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[4,5-g][1,2]benzodiazepine is sourced from PubChem (CID 67657169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).