2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline

C69H63NSi — CID 102191993

IUPAC2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline
SMILESCc1cc(C(c2ccccc2)c2ccccc2)c(N(c2c(C(c3ccccc3)c3ccccc3)cc(C)cc2C(c2ccccc2)c2ccccc2)[Si](C)(C)C)c(C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C69H63NSi/c1-50-46-60(64(52-30-14-6-15-31-52)53-32-16-7-17-33-53)68(61(47-50)65(54-34-18-8-19-35-54)55-36-20-9-21-37-55)70(71(3,4)5)69-62(66(56-38-22-10-23-39-56)57-40-24-11-25-41-57)48-51(2)49-63(69)67(58-42-26-12-27-43-58)59-44-28-13-29-45-59/h6-49,64-67H,1-5H3
InChIKeyRGBVGIDHBRGAOO-UHFFFAOYSA-N
MW934.36 g/mol
LogP18.00
Rot. Bonds15

About 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline

2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline (PubChem CID 102191993) has the molecular formula C69H63NSi and a molecular weight of 934.36 g/mol. Its IUPAC name is 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline.

Molecular Properties

Compound Name2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline
PubChem CID102191993
Molecular FormulaC69H63NSi
Molecular Weight934.36 g/mol
Exact Mass933.47
IUPAC Name2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline
SMILESCc1cc(C(c2ccccc2)c2ccccc2)c(N(c2c(C(c3ccccc3)c3ccccc3)cc(C)cc2C(c2ccccc2)c2ccccc2)[Si](C)(C)C)c(C(c2ccccc2)c2ccccc2)c1
InChIInChI=1S/C69H63NSi/c1-50-46-60(64(52-30-14-6-15-31-52)53-32-16-7-17-33-53)68(61(47-50)65(54-34-18-8-19-35-54)55-36-20-9-21-37-55)70(71(3,4)5)69-62(66(56-38-22-10-23-39-56)57-40-24-11-25-41-57)48-51(2)49-63(69)67(58-42-26-12-27-43-58)59-44-28-13-29-45-59/h6-49,64-67H,1-5H3
InChIKeyRGBVGIDHBRGAOO-UHFFFAOYSA-N
XLogP18.00
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms71
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500934.36
LogP ≤ 518.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline 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

2,6-dibenzhydryl-4-methyl-N-trichlorosilyl-N-trimethylsilylaniline
CID 139157119
1-[(3,5-dimethylphenyl)-phenylmethyl]-3,5-dimethylbenzene;ethane
CID 145412167
[4-(2,6-dibenzhydryl-4-methylphenyl)imidazol-2-ylidene]palladium
CID 175030395
2,4-dimethyl-1-[(4-methylphenyl)-phenylmethyl]benzene
CID 22389703
2-[[2-hydroxy-3-[(2-hydroxy-5-methylphenyl)-phenylmethyl]-5-methylphenyl]-phenylmethyl]-6-[(2-hydroxy-5-methylphenyl)-phenylmethyl]-4-methylphenol
CID 23156103
1-N,2-N-bis(2-benzhydryl-4,6-dimethylphenyl)acenaphthylene-1,2-diimine
CID 132837350
4-methyl-2,6-bis(1-phenylethyl)aniline;4-methyl-2,6-bis[(1R)-1-phenylethyl]aniline
CID 162252807
1-(2,6-dibenzhydryl-4-methoxyphenyl)-3-(2,6-dibenzhydryl-4-methylphenyl)-2H-imidazole
CID 158181373
(S)-(2-amino-3,5-dimethylphenyl)-phenylmethanol
CID 799505
1,3-dibenzhydryl-5-methoxy-2-methylbenzene
CID 170203409
1-[(3,4-dimethylphenyl)-phenylmethyl]-2,4-dimethylbenzene
CID 54025745
CID 166445578
CID 166445578

Frequently Asked Questions

What is the IUPAC name of 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline?
The IUPAC name of 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline (CID 102191993) is 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline.
What is the SMILES notation for 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline?
The canonical SMILES for 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline is Cc1cc(C(c2ccccc2)c2ccccc2)c(N(c2c(C(c3ccccc3)c3ccccc3)cc(C)cc2C(c2ccccc2)c2ccccc2)[Si](C)(C)C)c(C(c2ccccc2)c2ccccc2)c1.
What is the InChIKey of 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline?
The InChIKey is RGBVGIDHBRGAOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C69H63NSi/c1-50-46-60(64(52-30-14-6-15-31-52)53-32-16-7-17-33-53)68(61(47-50)65(54-34-18-8-19-35-54)55-36-20-9-21-37-55)70(71(3,4)5)69-62(66(56-38-22-10-23-39-56)57-40-24-11-25-41-57)48-51(2)49-63(69)67(58-42-26-12-27-43-58)59-44-28-13-29-45-59/h6-49,64-67H,1-5H3.
What are the key properties of 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline?
2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline has a molecular weight of 934.36 g/mol, XLogP of 18.00, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dibenzhydryl-N-(2,6-dibenzhydryl-4-methylphenyl)-4-methyl-N-trimethylsilylaniline is sourced from PubChem (CID 102191993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).