5,7-dihydrobenzo[d][1]benzazepin-6-one

C14H11NO — CID 11367798

IUPAC5,7-dihydrobenzo[d][1]benzazepin-6-one
SMILESO=C1Cc2ccccc2-c2ccccc2N1
InChIInChI=1S/C14H11NO/c16-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)15-14/h1-8H,9H2,(H,15,16)
InChIKeyXENVIBFIIPSBJW-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.85
Rot. Bonds

About 5,7-dihydrobenzo[d][1]benzazepin-6-one

5,7-dihydrobenzo[d][1]benzazepin-6-one (PubChem CID 11367798) has the molecular formula C14H11NO and a molecular weight of 209.25 g/mol. Its IUPAC name is 5,7-dihydrobenzo[d][1]benzazepin-6-one.

Molecular Properties

Compound Name5,7-dihydrobenzo[d][1]benzazepin-6-one
PubChem CID11367798
Molecular FormulaC14H11NO
Molecular Weight209.25 g/mol
Exact Mass209.08
IUPAC Name5,7-dihydrobenzo[d][1]benzazepin-6-one
SMILESO=C1Cc2ccccc2-c2ccccc2N1
InChIInChI=1S/C14H11NO/c16-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)15-14/h1-8H,9H2,(H,15,16)
InChIKeyXENVIBFIIPSBJW-UHFFFAOYSA-N
XLogP2.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5,7-dihydrobenzo[d][1]benzazepin-6-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 5,7-dihydrobenzo[d][1]benzazepin-6-one?
The IUPAC name of 5,7-dihydrobenzo[d][1]benzazepin-6-one (CID 11367798) is 5,7-dihydrobenzo[d][1]benzazepin-6-one.
What is the SMILES notation for 5,7-dihydrobenzo[d][1]benzazepin-6-one?
The canonical SMILES for 5,7-dihydrobenzo[d][1]benzazepin-6-one is O=C1Cc2ccccc2-c2ccccc2N1.
What is the InChIKey of 5,7-dihydrobenzo[d][1]benzazepin-6-one?
The InChIKey is XENVIBFIIPSBJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO/c16-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)15-14/h1-8H,9H2,(H,15,16).
What are the key properties of 5,7-dihydrobenzo[d][1]benzazepin-6-one?
5,7-dihydrobenzo[d][1]benzazepin-6-one has a molecular weight of 209.25 g/mol, XLogP of 2.85, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dihydrobenzo[d][1]benzazepin-6-one is sourced from PubChem (CID 11367798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).