8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol

C14H13NO — CID 69368794

IUPAC8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol
SMILESOC1=CC2=C(C=CCC2)Nc2ccccc21
InChIInChI=1S/C14H13NO/c16-14-9-10-5-1-3-7-12(10)15-13-8-4-2-6-11(13)14/h2-4,6-9,15-16H,1,5H2
InChIKeyUZHAXJYCNBDYSA-UHFFFAOYSA-N
MW211.26 g/mol
LogP3.62
Rot. Bonds

About 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol

8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol (PubChem CID 69368794) has the molecular formula C14H13NO and a molecular weight of 211.26 g/mol. Its IUPAC name is 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol.

Molecular Properties

Compound Name8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol
PubChem CID69368794
Molecular FormulaC14H13NO
Molecular Weight211.26 g/mol
Exact Mass211.10
IUPAC Name8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol
SMILESOC1=CC2=C(C=CCC2)Nc2ccccc21
InChIInChI=1S/C14H13NO/c16-14-9-10-5-1-3-7-12(10)15-13-8-4-2-6-11(13)14/h2-4,6-9,15-16H,1,5H2
InChIKeyUZHAXJYCNBDYSA-UHFFFAOYSA-N
XLogP3.62
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol?
The IUPAC name of 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol (CID 69368794) is 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol.
What is the SMILES notation for 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol?
The canonical SMILES for 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol is OC1=CC2=C(C=CCC2)Nc2ccccc21.
What is the InChIKey of 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol?
The InChIKey is UZHAXJYCNBDYSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO/c16-14-9-10-5-1-3-7-12(10)15-13-8-4-2-6-11(13)14/h2-4,6-9,15-16H,1,5H2.
What are the key properties of 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol?
8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol has a molecular weight of 211.26 g/mol, XLogP of 3.62, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8,11-dihydro-7H-benzo[b][1]benzazepin-5-ol is sourced from PubChem (CID 69368794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).