(4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine

C11H14BrN3O — CID 168529961

IUPAC(4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine
SMILESNN=Cc1ccc(Br)cc1N1CCOCC1
InChIInChI=1S/C11H14BrN3O/c12-10-2-1-9(8-14-13)11(7-10)15-3-5-16-6-4-15/h1-2,7-8H,3-6,13H2
InChIKeyPTUSUIQGXURDRB-UHFFFAOYSA-N
MW284.16 g/mol
LogP1.58
Rot. Bonds2

About (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine

(4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine (PubChem CID 168529961) has the molecular formula C11H14BrN3O and a molecular weight of 284.16 g/mol. Its IUPAC name is (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine.

Molecular Properties

Compound Name(4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine
PubChem CID168529961
Molecular FormulaC11H14BrN3O
Molecular Weight284.16 g/mol
Exact Mass283.03
IUPAC Name(4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine
SMILESNN=Cc1ccc(Br)cc1N1CCOCC1
InChIInChI=1S/C11H14BrN3O/c12-10-2-1-9(8-14-13)11(7-10)15-3-5-16-6-4-15/h1-2,7-8H,3-6,13H2
InChIKeyPTUSUIQGXURDRB-UHFFFAOYSA-N
XLogP1.58
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.16
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine 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 (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine?
The IUPAC name of (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine (CID 168529961) is (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine.
What is the SMILES notation for (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine?
The canonical SMILES for (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine is NN=Cc1ccc(Br)cc1N1CCOCC1.
What is the InChIKey of (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine?
The InChIKey is PTUSUIQGXURDRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrN3O/c12-10-2-1-9(8-14-13)11(7-10)15-3-5-16-6-4-15/h1-2,7-8H,3-6,13H2.
What are the key properties of (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine?
(4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine has a molecular weight of 284.16 g/mol, XLogP of 1.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2-morpholin-4-ylphenyl)methylidenehydrazine is sourced from PubChem (CID 168529961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).