(4-bromophenyl)-morpholin-4-yldiazene

C10H12BrN3O — CID 3419544

IUPAC(4-bromophenyl)-morpholin-4-yldiazene
SMILESBrc1ccc(/N=N/N2CCOCC2)cc1
InChIInChI=1S/C10H12BrN3O/c11-9-1-3-10(4-2-9)12-13-14-5-7-15-8-6-14/h1-4H,5-8H2/b13-12+
InChIKeyOBFKJDUASYMKGA-OUKQBFOZSA-N
MW270.13 g/mol
LogP2.78
Rot. Bonds2

About (4-bromophenyl)-morpholin-4-yldiazene

(4-bromophenyl)-morpholin-4-yldiazene (PubChem CID 3419544) has the molecular formula C10H12BrN3O and a molecular weight of 270.13 g/mol. Its IUPAC name is (4-bromophenyl)-morpholin-4-yldiazene.

Molecular Properties

Compound Name(4-bromophenyl)-morpholin-4-yldiazene
PubChem CID3419544
Molecular FormulaC10H12BrN3O
Molecular Weight270.13 g/mol
Exact Mass269.02
IUPAC Name(4-bromophenyl)-morpholin-4-yldiazene
SMILESBrc1ccc(/N=N/N2CCOCC2)cc1
InChIInChI=1S/C10H12BrN3O/c11-9-1-3-10(4-2-9)12-13-14-5-7-15-8-6-14/h1-4H,5-8H2/b13-12+
InChIKeyOBFKJDUASYMKGA-OUKQBFOZSA-N
XLogP2.78
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.13
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-morpholin-4-yldiazene?
The IUPAC name of (4-bromophenyl)-morpholin-4-yldiazene (CID 3419544) is (4-bromophenyl)-morpholin-4-yldiazene.
What is the SMILES notation for (4-bromophenyl)-morpholin-4-yldiazene?
The canonical SMILES for (4-bromophenyl)-morpholin-4-yldiazene is Brc1ccc(/N=N/N2CCOCC2)cc1.
What is the InChIKey of (4-bromophenyl)-morpholin-4-yldiazene?
The InChIKey is OBFKJDUASYMKGA-OUKQBFOZSA-N. The full InChI is InChI=1S/C10H12BrN3O/c11-9-1-3-10(4-2-9)12-13-14-5-7-15-8-6-14/h1-4H,5-8H2/b13-12+.
What are the key properties of (4-bromophenyl)-morpholin-4-yldiazene?
(4-bromophenyl)-morpholin-4-yldiazene has a molecular weight of 270.13 g/mol, XLogP of 2.78, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-morpholin-4-yldiazene is sourced from PubChem (CID 3419544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).