N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine

C15H14N2O — CID 154103165

IUPACN-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine
SMILESCN1c2ccccc2CC(=NO)c2ccccc21
InChIInChI=1S/C15H14N2O/c1-17-14-8-4-2-6-11(14)10-13(16-18)12-7-3-5-9-15(12)17/h2-9,18H,10H2,1H3
InChIKeyXFLCOODLBRLMOM-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.19
Rot. Bonds

About N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine

N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine (PubChem CID 154103165) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine.

Molecular Properties

Compound NameN-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine
PubChem CID154103165
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC NameN-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine
SMILESCN1c2ccccc2CC(=NO)c2ccccc21
InChIInChI=1S/C15H14N2O/c1-17-14-8-4-2-6-11(14)10-13(16-18)12-7-3-5-9-15(12)17/h2-9,18H,10H2,1H3
InChIKeyXFLCOODLBRLMOM-UHFFFAOYSA-N
XLogP3.19
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)methanamine
CID 57356776
10-methyl-9H-acridin-1-ol
CID 67275836
5-methyl-8,13-dihydroindeno[1,2-a]acridine
CID 158084314
5-methyl-11,12-dihydro-10H-benzo[b][1]benzazocine
CID 58892341
1-methyl-3H-indole-2-thione
CID 26156
1-(3-hydroxyimino-2H-indol-1-yl)ethanone
CID 71820179
(3E)-3-hydroxyiminoinden-1-one
CID 6418558
N-[1-(3-methylbutyl)-2,3-dihydroquinolin-4-ylidene]hydroxylamine
CID 77033810
10-methyl-9H-acridine-1-carbothioic S-acid
CID 150025643
(NZ)-N-[1-(2-methoxyethyl)-3,4-dihydro-2H-1-benzazepin-5-ylidene]hydroxylamine
CID 114337205
8-methyl-8-azatricyclo[11.4.0.02,7]heptadeca-1(17),2,4,6,13,15-hexaen-9-one
CID 46930002
5-methyl-11,12-dihydrobenzo[c][1]benzazocin-6-one
CID 13447635

Frequently Asked Questions

What is the IUPAC name of N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine?
The IUPAC name of N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine (CID 154103165) is N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine.
What is the SMILES notation for N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine?
The canonical SMILES for N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine is CN1c2ccccc2CC(=NO)c2ccccc21.
What is the InChIKey of N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine?
The InChIKey is XFLCOODLBRLMOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-17-14-8-4-2-6-11(14)10-13(16-18)12-7-3-5-9-15(12)17/h2-9,18H,10H2,1H3.
What are the key properties of N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine?
N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine has a molecular weight of 238.29 g/mol, XLogP of 3.19, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(11-methyl-6H-benzo[b][1]benzazepin-5-ylidene)hydroxylamine is sourced from PubChem (CID 154103165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).