benzo[d][1]benzazepin-11-one

C14H9NO — CID 22390471

IUPACbenzo[d][1]benzazepin-11-one
SMILESO=c1cccc2ccnc3ccccc3c1-2
InChIInChI=1S/C14H9NO/c16-13-7-3-4-10-8-9-15-12-6-2-1-5-11(12)14(10)13/h1-9H
InChIKeyVUCJPMJYWQSCGD-UHFFFAOYSA-N
MW207.23 g/mol
LogP2.70
Rot. Bonds

About benzo[d][1]benzazepin-11-one

benzo[d][1]benzazepin-11-one (PubChem CID 22390471) has the molecular formula C14H9NO and a molecular weight of 207.23 g/mol. Its IUPAC name is benzo[d][1]benzazepin-11-one.

Molecular Properties

Compound Namebenzo[d][1]benzazepin-11-one
PubChem CID22390471
Molecular FormulaC14H9NO
Molecular Weight207.23 g/mol
Exact Mass207.07
IUPAC Namebenzo[d][1]benzazepin-11-one
SMILESO=c1cccc2ccnc3ccccc3c1-2
InChIInChI=1S/C14H9NO/c16-13-7-3-4-10-8-9-15-12-6-2-1-5-11(12)14(10)13/h1-9H
InChIKeyVUCJPMJYWQSCGD-UHFFFAOYSA-N
XLogP2.70
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzo[d][1]benzazepin-11-one?
The IUPAC name of benzo[d][1]benzazepin-11-one (CID 22390471) is benzo[d][1]benzazepin-11-one.
What is the SMILES notation for benzo[d][1]benzazepin-11-one?
The canonical SMILES for benzo[d][1]benzazepin-11-one is O=c1cccc2ccnc3ccccc3c1-2.
What is the InChIKey of benzo[d][1]benzazepin-11-one?
The InChIKey is VUCJPMJYWQSCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9NO/c16-13-7-3-4-10-8-9-15-12-6-2-1-5-11(12)14(10)13/h1-9H.
What are the key properties of benzo[d][1]benzazepin-11-one?
benzo[d][1]benzazepin-11-one has a molecular weight of 207.23 g/mol, XLogP of 2.70, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[d][1]benzazepin-11-one is sourced from PubChem (CID 22390471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).