10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one

C17H14N2O — CID 10539412

IUPAC10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one
SMILESCn1c2c(c3ccccc31)Nc1ccccc1C(=O)C2
InChIInChI=1S/C17H14N2O/c1-19-14-9-5-3-7-12(14)17-15(19)10-16(20)11-6-2-4-8-13(11)18-17/h2-9,18H,10H2,1H3
InChIKeyYIPYVBGKXIVZNU-UHFFFAOYSA-N
MW262.31 g/mol
LogP3.66
Rot. Bonds

About 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one

10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one (PubChem CID 10539412) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one.

Molecular Properties

Compound Name10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one
PubChem CID10539412
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC Name10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one
SMILESCn1c2c(c3ccccc31)Nc1ccccc1C(=O)C2
InChIInChI=1S/C17H14N2O/c1-19-14-9-5-3-7-12(14)17-15(19)10-16(20)11-6-2-4-8-13(11)18-17/h2-9,18H,10H2,1H3
InChIKeyYIPYVBGKXIVZNU-UHFFFAOYSA-N
XLogP3.66
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one?
The IUPAC name of 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one (CID 10539412) is 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one.
What is the SMILES notation for 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one?
The canonical SMILES for 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one is Cn1c2c(c3ccccc31)Nc1ccccc1C(=O)C2.
What is the InChIKey of 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one?
The InChIKey is YIPYVBGKXIVZNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O/c1-19-14-9-5-3-7-12(14)17-15(19)10-16(20)11-6-2-4-8-13(11)18-17/h2-9,18H,10H2,1H3.
What are the key properties of 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one?
10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one has a molecular weight of 262.31 g/mol, XLogP of 3.66, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methyl-5,11-dihydroindolo[3,2-b][1]benzazepin-12-one is sourced from PubChem (CID 10539412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).