[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene

C27H26N2OSi — CID 21342367

IUPAC[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene
SMILESCOc1c(/N=N/c2ccccc2)cc(C)cc1[Si](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H26N2OSi/c1-21-19-25(29-28-22-13-7-4-8-14-22)27(30-2)26(20-21)31(3,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-20H,1-3H3/b29-28+
InChIKeyLVUVLYUOKTVXGY-ZQHSETAFSA-N
MW422.60 g/mol
LogP5.52
Rot. Bonds6

About [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene

[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene (PubChem CID 21342367) has the molecular formula C27H26N2OSi and a molecular weight of 422.60 g/mol. Its IUPAC name is [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene.

Molecular Properties

Compound Name[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene
PubChem CID21342367
Molecular FormulaC27H26N2OSi
Molecular Weight422.60 g/mol
Exact Mass422.18
IUPAC Name[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene
SMILESCOc1c(/N=N/c2ccccc2)cc(C)cc1[Si](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H26N2OSi/c1-21-19-25(29-28-22-13-7-4-8-14-22)27(30-2)26(20-21)31(3,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-20H,1-3H3/b29-28+
InChIKeyLVUVLYUOKTVXGY-ZQHSETAFSA-N
XLogP5.52
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500422.60
LogP ≤ 55.52
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'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

[2-[methyl(diphenyl)silyl]phenyl]-phenyldiazene
CID 139118290
[dimethyl(phenyl)silyl]-(2-methoxy-3,5-dimethylphenyl)diazene
CID 21343001
2-[(2-methoxy-3,5-dimethylphenyl)diazenyl]phenol
CID 135597406
2-chloro-3,6-dimethoxy-4-phenyldiazenylaniline
CID 21417382
2-methoxy-4-phenyldiazenylnaphthalen-1-amine
CID 23338736
[2-methoxy-3,5-bis(2-phenylpropan-2-yl)phenyl]-phenyldiazene
CID 21342333
(2-methoxy-3-phenylphenyl)-phenyldiazene
CID 21342365
bis[2-[fluoro(diphenyl)silyl]-4-methylphenyl]diazene
CID 25136863
4-methyl-2-[(4-phenyldiazenylphenyl)diazenyl]phenol
CID 3519903
N-(2-methoxy-3,5-dimethylphenyl)iminobenzenesulfonamide
CID 21343022
(2-methoxy-5-methylphenyl)-dimethyl-phenylsilane
CID 101027694
3,6-dimethoxy-2-nitro-4-phenyldiazenylaniline
CID 88767483

Frequently Asked Questions

What is the IUPAC name of [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene?
The IUPAC name of [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene (CID 21342367) is [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene.
What is the SMILES notation for [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene?
The canonical SMILES for [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene is COc1c(/N=N/c2ccccc2)cc(C)cc1[Si](C)(c1ccccc1)c1ccccc1.
What is the InChIKey of [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene?
The InChIKey is LVUVLYUOKTVXGY-ZQHSETAFSA-N. The full InChI is InChI=1S/C27H26N2OSi/c1-21-19-25(29-28-22-13-7-4-8-14-22)27(30-2)26(20-21)31(3,23-15-9-5-10-16-23)24-17-11-6-12-18-24/h4-20H,1-3H3/b29-28+.
What are the key properties of [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene?
[2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene has a molecular weight of 422.60 g/mol, XLogP of 5.52, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methoxy-5-methyl-3-[methyl(diphenyl)silyl]phenyl]-phenyldiazene is sourced from PubChem (CID 21342367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).