[4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol

C27H38N2OSi2 — CID 11340199

IUPAC[4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol
SMILESCN(C)c1ccc(C(O)(c2ccccc2)c2ccc(N([Si](C)(C)C)[Si](C)(C)C)cc2)cc1
InChIInChI=1S/C27H38N2OSi2/c1-28(2)25-18-14-23(15-19-25)27(30,22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(31(3,4)5)32(6,7)8/h9-21,30H,1-8H3
InChIKeyUAGPBKPCWWECOU-UHFFFAOYSA-N
MW462.79 g/mol
LogP6.51
Rot. Bonds7

About [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol

[4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol (PubChem CID 11340199) has the molecular formula C27H38N2OSi2 and a molecular weight of 462.79 g/mol. Its IUPAC name is [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol.

Molecular Properties

Compound Name[4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol
PubChem CID11340199
Molecular FormulaC27H38N2OSi2
Molecular Weight462.79 g/mol
Exact Mass462.25
IUPAC Name[4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol
SMILESCN(C)c1ccc(C(O)(c2ccccc2)c2ccc(N([Si](C)(C)C)[Si](C)(C)C)cc2)cc1
InChIInChI=1S/C27H38N2OSi2/c1-28(2)25-18-14-23(15-19-25)27(30,22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(31(3,4)5)32(6,7)8/h9-21,30H,1-8H3
InChIKeyUAGPBKPCWWECOU-UHFFFAOYSA-N
XLogP6.51
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.79
LogP ≤ 56.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_D(198)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol?
The IUPAC name of [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol (CID 11340199) is [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol.
What is the SMILES notation for [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol?
The canonical SMILES for [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol is CN(C)c1ccc(C(O)(c2ccccc2)c2ccc(N([Si](C)(C)C)[Si](C)(C)C)cc2)cc1.
What is the InChIKey of [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol?
The InChIKey is UAGPBKPCWWECOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H38N2OSi2/c1-28(2)25-18-14-23(15-19-25)27(30,22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(31(3,4)5)32(6,7)8/h9-21,30H,1-8H3.
What are the key properties of [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol?
[4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol has a molecular weight of 462.79 g/mol, XLogP of 6.51, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[bis(trimethylsilyl)amino]phenyl]-[4-(dimethylamino)phenyl]-phenylmethanol is sourced from PubChem (CID 11340199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).