3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol

C13H19N3O3 — CID 102354378

IUPAC3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol
SMILESOCCCOc1ccc(/N=N/N2CCOCC2)cc1
InChIInChI=1S/C13H19N3O3/c17-8-1-9-19-13-4-2-12(3-5-13)14-15-16-6-10-18-11-7-16/h2-5,17H,1,6-11H2/b15-14+
InChIKeyJXFIFIPYIMBVRH-CCEZHUSRSA-N
MW265.31 g/mol
LogP1.78
Rot. Bonds6

About 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol

3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol (PubChem CID 102354378) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol.

Molecular Properties

Compound Name3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol
PubChem CID102354378
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC Name3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol
SMILESOCCCOc1ccc(/N=N/N2CCOCC2)cc1
InChIInChI=1S/C13H19N3O3/c17-8-1-9-19-13-4-2-12(3-5-13)14-15-16-6-10-18-11-7-16/h2-5,17H,1,6-11H2/b15-14+
InChIKeyJXFIFIPYIMBVRH-CCEZHUSRSA-N
XLogP1.78
TPSA66.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

10-[4-[[4-(10-hydroxydecoxy)phenyl]diazenyl]phenoxy]decan-1-ol
CID 100941913
6-[4-[[4-(6-hydroxyhexoxy)phenyl]diazenyl]phenoxy]hexan-1-ol
CID 44604101
3-[4-[(4-methoxyphenyl)diazenyl]phenoxy]propan-1-ol
CID 86231691
potassium 4-(morpholin-4-yldiazenyl)benzenesulfonic acid
CID 126467905
(4-butoxyphenyl)-[4-[4-[4-[(4-butoxyphenyl)diazenyl]phenyl]piperazin-1-yl]phenyl]diazene
CID 139387004
6-[4-[(2-ethoxyphenyl)diazenyl]phenoxy]hexan-1-ol
CID 139076124
(4-butoxyphenyl)-[4-[8-[4-[(4-butoxyphenyl)diazenyl]phenoxy]octoxy]phenyl]diazene
CID 101490875
4-(3-hydroxypropoxy)benzoic acid
CID 13423286
10-[4-[[4-[2-[4-(2-methoxyethoxy)phenyl]ethynyl]phenyl]diazenyl]phenoxy]decan-1-ol
CID 102104313
5-(morpholin-4-yldiazenyl)benzene-1,3-dicarbonitrile
CID 54043988
6-[4-[[4-(6-hydroxyhexoxy)phenyl]diazenyl]phenoxy]hexyl prop-2-enoate
CID 101498124
5-[4-[[4-[(2-methyl-4-morpholin-4-ylphenyl)diazenyl]phenyl]diazenyl]phenoxy]pentyl propanoate
CID 166512675

Frequently Asked Questions

What is the IUPAC name of 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol?
The IUPAC name of 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol (CID 102354378) is 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol.
What is the SMILES notation for 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol?
The canonical SMILES for 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol is OCCCOc1ccc(/N=N/N2CCOCC2)cc1.
What is the InChIKey of 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol?
The InChIKey is JXFIFIPYIMBVRH-CCEZHUSRSA-N. The full InChI is InChI=1S/C13H19N3O3/c17-8-1-9-19-13-4-2-12(3-5-13)14-15-16-6-10-18-11-7-16/h2-5,17H,1,6-11H2/b15-14+.
What are the key properties of 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol?
3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol has a molecular weight of 265.31 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(morpholin-4-yldiazenyl)phenoxy]propan-1-ol is sourced from PubChem (CID 102354378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).