10-aminothieno[2,3-c][1]benzazepin-4-one

C12H8N2OS — CID 70103346

IUPAC10-aminothieno[2,3-c][1]benzazepin-4-one
SMILESNc1c2ccccc2nc(=O)c2sccc12
InChIInChI=1S/C12H8N2OS/c13-10-7-3-1-2-4-9(7)14-12(15)11-8(10)5-6-16-11/h1-6H,13H2
InChIKeyYOYZMMICLSNKII-UHFFFAOYSA-N
MW228.28 g/mol
LogP2.39
Rot. Bonds

About 10-aminothieno[2,3-c][1]benzazepin-4-one

10-aminothieno[2,3-c][1]benzazepin-4-one (PubChem CID 70103346) has the molecular formula C12H8N2OS and a molecular weight of 228.28 g/mol. Its IUPAC name is 10-aminothieno[2,3-c][1]benzazepin-4-one.

Molecular Properties

Compound Name10-aminothieno[2,3-c][1]benzazepin-4-one
PubChem CID70103346
Molecular FormulaC12H8N2OS
Molecular Weight228.28 g/mol
Exact Mass228.04
IUPAC Name10-aminothieno[2,3-c][1]benzazepin-4-one
SMILESNc1c2ccccc2nc(=O)c2sccc12
InChIInChI=1S/C12H8N2OS/c13-10-7-3-1-2-4-9(7)14-12(15)11-8(10)5-6-16-11/h1-6H,13H2
InChIKeyYOYZMMICLSNKII-UHFFFAOYSA-N
XLogP2.39
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 10-aminothieno[2,3-c][1]benzazepin-4-one?
The IUPAC name of 10-aminothieno[2,3-c][1]benzazepin-4-one (CID 70103346) is 10-aminothieno[2,3-c][1]benzazepin-4-one.
What is the SMILES notation for 10-aminothieno[2,3-c][1]benzazepin-4-one?
The canonical SMILES for 10-aminothieno[2,3-c][1]benzazepin-4-one is Nc1c2ccccc2nc(=O)c2sccc12.
What is the InChIKey of 10-aminothieno[2,3-c][1]benzazepin-4-one?
The InChIKey is YOYZMMICLSNKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2OS/c13-10-7-3-1-2-4-9(7)14-12(15)11-8(10)5-6-16-11/h1-6H,13H2.
What are the key properties of 10-aminothieno[2,3-c][1]benzazepin-4-one?
10-aminothieno[2,3-c][1]benzazepin-4-one has a molecular weight of 228.28 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-aminothieno[2,3-c][1]benzazepin-4-one is sourced from PubChem (CID 70103346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).