(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene

C15H16N2O2 — CID 157276293

IUPAC(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene
SMILESCOc1cccc(C/N=N/c2cccc(OC)c2)c1
InChIInChI=1S/C15H16N2O2/c1-18-14-7-3-5-12(9-14)11-16-17-13-6-4-8-15(10-13)19-2/h3-10H,11H2,1-2H3/b17-16+
InChIKeySJLACYNSOIUHFH-WUKNDPDISA-N
MW256.31 g/mol
LogP3.99
Rot. Bonds5

About (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene

(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene (PubChem CID 157276293) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene.

Molecular Properties

Compound Name(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene
PubChem CID157276293
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC Name(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene
SMILESCOc1cccc(C/N=N/c2cccc(OC)c2)c1
InChIInChI=1S/C15H16N2O2/c1-18-14-7-3-5-12(9-14)11-16-17-13-6-4-8-15(10-13)19-2/h3-10H,11H2,1-2H3/b17-16+
InChIKeySJLACYNSOIUHFH-WUKNDPDISA-N
XLogP3.99
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 53.99
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

(3-methoxyphenyl)-naphthalen-2-yldiazene
CID 581663
1-ethyl-3-methoxybenzene;hydrofluoride
CID 174493623
(3-methoxyphenyl)(113C)methanol
CID 11593446
(3-methoxyphenyl)methanethiol
CID 10749403
4-[[3-methoxy-4-(3-methoxybenzoyl)oxyphenyl]methyldiazenyl]benzoic acid
CID 91897133
1-methoxy-3-propylbenzene
CID 14270128
2-fluoro-4-[[(4-methoxyphenyl)diazenyl]methyl]phenol
CID 71544063
2-(hydroxymethyl)-4-[(3-methoxyphenyl)diazenyl]phenol
CID 136794349
bis(2-[(3-methoxyphenyl)methyl]guanidine);sulfuric acid
CID 43810780
CID 87640434
CID 87640434
sodium N-(3-methoxyphenyl)iminosulfamate
CID 23715155
1-methoxy-3-pent-2-ynylbenzene
CID 18736329

Frequently Asked Questions

What is the IUPAC name of (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene?
The IUPAC name of (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene (CID 157276293) is (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene.
What is the SMILES notation for (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene?
The canonical SMILES for (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene is COc1cccc(C/N=N/c2cccc(OC)c2)c1.
What is the InChIKey of (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene?
The InChIKey is SJLACYNSOIUHFH-WUKNDPDISA-N. The full InChI is InChI=1S/C15H16N2O2/c1-18-14-7-3-5-12(9-14)11-16-17-13-6-4-8-15(10-13)19-2/h3-10H,11H2,1-2H3/b17-16+.
What are the key properties of (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene?
(3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene has a molecular weight of 256.31 g/mol, XLogP of 3.99, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxyphenyl)-[(3-methoxyphenyl)methyl]diazene is sourced from PubChem (CID 157276293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).