6H-chromeno[2,3-b][1,5]benzodiazepin-13-one

C16H10N2O2 — CID 3054330

IUPAC6H-chromeno[2,3-b][1,5]benzodiazepin-13-one
SMILESO=c1c2c(oc3ccccc13)Nc1ccccc1N=C2
InChIInChI=1S/C16H10N2O2/c19-15-10-5-1-4-8-14(10)20-16-11(15)9-17-12-6-2-3-7-13(12)18-16/h1-9,18H
InChIKeyCSKPIXHLJPICKM-UHFFFAOYSA-N
MW262.27 g/mol
LogP3.60
Rot. Bonds

About 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one

6H-chromeno[2,3-b][1,5]benzodiazepin-13-one (PubChem CID 3054330) has the molecular formula C16H10N2O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one.

Molecular Properties

Compound Name6H-chromeno[2,3-b][1,5]benzodiazepin-13-one
PubChem CID3054330
Molecular FormulaC16H10N2O2
Molecular Weight262.27 g/mol
Exact Mass262.07
IUPAC Name6H-chromeno[2,3-b][1,5]benzodiazepin-13-one
SMILESO=c1c2c(oc3ccccc13)Nc1ccccc1N=C2
InChIInChI=1S/C16H10N2O2/c19-15-10-5-1-4-8-14(10)20-16-11(15)9-17-12-6-2-3-7-13(12)18-16/h1-9,18H
InChIKeyCSKPIXHLJPICKM-UHFFFAOYSA-N
XLogP3.60
TPSA54.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one?
The IUPAC name of 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one (CID 3054330) is 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one.
What is the SMILES notation for 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one?
The canonical SMILES for 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one is O=c1c2c(oc3ccccc13)Nc1ccccc1N=C2.
What is the InChIKey of 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one?
The InChIKey is CSKPIXHLJPICKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2/c19-15-10-5-1-4-8-14(10)20-16-11(15)9-17-12-6-2-3-7-13(12)18-16/h1-9,18H.
What are the key properties of 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one?
6H-chromeno[2,3-b][1,5]benzodiazepin-13-one has a molecular weight of 262.27 g/mol, XLogP of 3.60, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-chromeno[2,3-b][1,5]benzodiazepin-13-one is sourced from PubChem (CID 3054330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).