[(E)-2-morpholin-4-ylethenyl]-phenyldiazene

C12H15N3O — CID 44579281

IUPAC[(E)-2-morpholin-4-ylethenyl]-phenyldiazene
SMILESC(=C/N1CCOCC1)\N=N\c1ccccc1
InChIInChI=1S/C12H15N3O/c1-2-4-12(5-3-1)14-13-6-7-15-8-10-16-11-9-15/h1-7H,8-11H2/b7-6+,14-13+
InChIKeyZZJZGISTFKBICI-ZGDGPSKSSA-N
MW217.27 g/mol
LogP2.57
Rot. Bonds3

About [(E)-2-morpholin-4-ylethenyl]-phenyldiazene

[(E)-2-morpholin-4-ylethenyl]-phenyldiazene (PubChem CID 44579281) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is [(E)-2-morpholin-4-ylethenyl]-phenyldiazene.

Molecular Properties

Compound Name[(E)-2-morpholin-4-ylethenyl]-phenyldiazene
PubChem CID44579281
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name[(E)-2-morpholin-4-ylethenyl]-phenyldiazene
SMILESC(=C/N1CCOCC1)\N=N\c1ccccc1
InChIInChI=1S/C12H15N3O/c1-2-4-12(5-3-1)14-13-6-7-15-8-10-16-11-9-15/h1-7H,8-11H2/b7-6+,14-13+
InChIKeyZZJZGISTFKBICI-ZGDGPSKSSA-N
XLogP2.57
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-Phenylmorpholine
CID 62339
Benzenamine, 4-(4-morpholinyl)-
CID 75655
Benzenediazonium, 4-(4-morpholinyl)-, chloride, compd. with zinc chloride (ZnCl2) (1:1:?)
CID 87100
Morpholine, 4-[(4-chlorophenyl)azo]-
CID 2726102
4-(4-Fluorophenyl)morpholine
CID 11355855
4-[(4-Nitrophenyl)azo]-morpholine
CID 280475
Benzenediazonium, 4-(4-morpholinyl)-, hexafluorophosphate(1-) (1:1)
CID 170095
4-(4-Iodophenyl)morpholine
CID 2795358
(4-(Morpholin-4-yl)phenyl)boronic acid
CID 2795359
4-(3-Iodophenyl)morpholine
CID 54536434
4-[(E)-(4-bromophenyl)diazenyl]morpholine
CID 3419544
phenyl-[(E)-2-piperidin-1-ylethenyl]diazene
CID 12216656

Frequently Asked Questions

What is the IUPAC name of [(E)-2-morpholin-4-ylethenyl]-phenyldiazene?
The IUPAC name of [(E)-2-morpholin-4-ylethenyl]-phenyldiazene (CID 44579281) is [(E)-2-morpholin-4-ylethenyl]-phenyldiazene.
What is the SMILES notation for [(E)-2-morpholin-4-ylethenyl]-phenyldiazene?
The canonical SMILES for [(E)-2-morpholin-4-ylethenyl]-phenyldiazene is C(=C/N1CCOCC1)\N=N\c1ccccc1.
What is the InChIKey of [(E)-2-morpholin-4-ylethenyl]-phenyldiazene?
The InChIKey is ZZJZGISTFKBICI-ZGDGPSKSSA-N. The full InChI is InChI=1S/C12H15N3O/c1-2-4-12(5-3-1)14-13-6-7-15-8-10-16-11-9-15/h1-7H,8-11H2/b7-6+,14-13+.
What are the key properties of [(E)-2-morpholin-4-ylethenyl]-phenyldiazene?
[(E)-2-morpholin-4-ylethenyl]-phenyldiazene has a molecular weight of 217.27 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-morpholin-4-ylethenyl]-phenyldiazene is sourced from PubChem (CID 44579281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).