bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride

C22H30ClN6O4- — CID 123629300

IUPACbis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride
SMILES[Cl-].[H]/N=N/c1ccc(N2CCOCC2)cc1OC.[H]/N=N/c1ccc(N2CCOCC2)cc1OC
InChIInChI=1S/2C11H15N3O2.ClH/c2*1-15-11-8-9(2-3-10(11)13-12)14-4-6-16-7-5-14;/h2*2-3,8,12H,4-7H2,1H3;1H/p-1/b2*13-12+;
InChIKeyMFZQEKLIJGSVPM-ZVYVTKPGSA-M
MW477.97 g/mol
LogP1.39
Rot. Bonds6

About bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride

bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride (PubChem CID 123629300) has the molecular formula C22H30ClN6O4- and a molecular weight of 477.97 g/mol. Its IUPAC name is bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride.

Molecular Properties

Compound Namebis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride
PubChem CID123629300
Molecular FormulaC22H30ClN6O4-
Molecular Weight477.97 g/mol
Exact Mass477.20
IUPAC Namebis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride
SMILES[Cl-].[H]/N=N/c1ccc(N2CCOCC2)cc1OC.[H]/N=N/c1ccc(N2CCOCC2)cc1OC
InChIInChI=1S/2C11H15N3O2.ClH/c2*1-15-11-8-9(2-3-10(11)13-12)14-4-6-16-7-5-14;/h2*2-3,8,12H,4-7H2,1H3;1H/p-1/b2*13-12+;
InChIKeyMFZQEKLIJGSVPM-ZVYVTKPGSA-M
XLogP1.39
TPSA115.82 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.97
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

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-[4-(1,1-dimethoxyethyl)-3-methoxyphenyl]morpholine
CID 174708451
4-[3,5-dimethoxy-4-[(2-methoxy-4-morpholin-4-ylphenyl)methyl]phenyl]morpholine
CID 135200868
4-(3,4-diethoxyphenyl)morpholine
CID 154477521
N-(5-chloro-2-methylphenyl)-1-(2-methoxy-4-morpholin-4-ylphenyl)methanimine
CID 126246715
methyl 4-[(2-methoxy-4-morpholin-4-ylphenyl)methylideneamino]benzoate
CID 126245259
2-amino-1-(2-methoxy-5-morpholin-4-ylphenyl)ethanol
CID 117384184
N-(2-methoxy-4-morpholin-4-ylphenyl)-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
CID 58865823
1-(2-methoxy-4-morpholin-4-ylphenyl)-N-(3-methylphenyl)methanimine
CID 126238269
4-bromo-1-methoxy-2-nitrobenzene;4-(4-methoxy-3-nitrophenyl)morpholine
CID 162166043
(E)-4-(2-methoxy-4-morpholin-4-ylphenyl)-2-oxobut-3-enoic acid
CID 126743116
(E)-3-(2-methoxy-5-morpholin-4-ylphenyl)prop-2-en-1-amine
CID 117374281
1-(2-methoxy-5-morpholin-4-ylphenyl)cyclohexan-1-amine
CID 117469481

Frequently Asked Questions

What is the IUPAC name of bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride?
The IUPAC name of bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride (CID 123629300) is bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride.
What is the SMILES notation for bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride?
The canonical SMILES for bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride is [Cl-].[H]/N=N/c1ccc(N2CCOCC2)cc1OC.[H]/N=N/c1ccc(N2CCOCC2)cc1OC.
What is the InChIKey of bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride?
The InChIKey is MFZQEKLIJGSVPM-ZVYVTKPGSA-M. The full InChI is InChI=1S/2C11H15N3O2.ClH/c2*1-15-11-8-9(2-3-10(11)13-12)14-4-6-16-7-5-14;/h2*2-3,8,12H,4-7H2,1H3;1H/p-1/b2*13-12+;.
What are the key properties of bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride?
bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride has a molecular weight of 477.97 g/mol, XLogP of 1.39, 6 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for bis((2-methoxy-4-morpholin-4-ylphenyl)diazene);chloride is sourced from PubChem (CID 123629300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).