1H-3-benzazepin-1-ol

C10H9NO — CID 67873283

IUPAC1H-3-benzazepin-1-ol
SMILESOC1C=NC=Cc2ccccc21
InChIInChI=1S/C10H9NO/c12-10-7-11-6-5-8-3-1-2-4-9(8)10/h1-7,10,12H
InChIKeyYGJMJTAQOLQTMN-UHFFFAOYSA-N
MW159.19 g/mol
LogP1.78
Rot. Bonds

About 1H-3-benzazepin-1-ol

1H-3-benzazepin-1-ol (PubChem CID 67873283) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 1H-3-benzazepin-1-ol.

Molecular Properties

Compound Name1H-3-benzazepin-1-ol
PubChem CID67873283
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name1H-3-benzazepin-1-ol
SMILESOC1C=NC=Cc2ccccc21
InChIInChI=1S/C10H9NO/c12-10-7-11-6-5-8-3-1-2-4-9(8)10/h1-7,10,12H
InChIKeyYGJMJTAQOLQTMN-UHFFFAOYSA-N
XLogP1.78
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1H-3-benzazepin-1-ol 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 1H-3-benzazepin-1-ol?
The IUPAC name of 1H-3-benzazepin-1-ol (CID 67873283) is 1H-3-benzazepin-1-ol.
What is the SMILES notation for 1H-3-benzazepin-1-ol?
The canonical SMILES for 1H-3-benzazepin-1-ol is OC1C=NC=Cc2ccccc21.
What is the InChIKey of 1H-3-benzazepin-1-ol?
The InChIKey is YGJMJTAQOLQTMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c12-10-7-11-6-5-8-3-1-2-4-9(8)10/h1-7,10,12H.
What are the key properties of 1H-3-benzazepin-1-ol?
1H-3-benzazepin-1-ol has a molecular weight of 159.19 g/mol, XLogP of 1.78, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-3-benzazepin-1-ol is sourced from PubChem (CID 67873283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).