4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline

C23H27BrN2Si — CID 150315249

IUPAC4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc([SiH](Cc2ccc(Br)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C23H27BrN2Si/c1-25(2)20-9-13-22(14-10-20)27(17-18-5-7-19(24)8-6-18)23-15-11-21(12-16-23)26(3)4/h5-16,27H,17H2,1-4H3
InChIKeyGMLWGHWPTZVVRR-UHFFFAOYSA-N
MW439.47 g/mol
LogP3.70
Rot. Bonds6

About 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline

4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline (PubChem CID 150315249) has the molecular formula C23H27BrN2Si and a molecular weight of 439.47 g/mol. Its IUPAC name is 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline
PubChem CID150315249
Molecular FormulaC23H27BrN2Si
Molecular Weight439.47 g/mol
Exact Mass438.11
IUPAC Name4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc([SiH](Cc2ccc(Br)cc2)c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C23H27BrN2Si/c1-25(2)20-9-13-22(14-10-20)27(17-18-5-7-19(24)8-6-18)23-15-11-21(12-16-23)26(3)4/h5-16,27H,17H2,1-4H3
InChIKeyGMLWGHWPTZVVRR-UHFFFAOYSA-N
XLogP3.70
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.47
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline 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

4-bromo-N,N-dimethylaniline tetrafluoroborate
CID 175482314
4-[[1-(4-bromophenyl)propylamino]methyl]-N,N-dimethylaniline
CID 43182464
4-[[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline
CID 7567
[4-(dimethylamino)phenyl]methyl-λ2-stannane
CID 174712145
2-(4-bromophenyl)sulfanyl-N-[[4-(dimethylamino)phenyl]methyl]-N-methylacetamide
CID 26570911
N-[(4-bromophenyl)methyl]-4-(chloromethyl)-N-methylaniline
CID 63540991
1-(4-bromophenyl)-3-[4-(dimethylamino)phenyl]urea
CID 100973286
1-(4-bromophenyl)-1-methylhydrazine
CID 12754267
4-(2-bromoprop-2-enyl)-N,N-dimethylaniline
CID 24721880
N-[(4-bromophenyl)methyl]-N-methylpropan-1-amine
CID 60777785
4-bromo-N,N-dipropylaniline
CID 10445113
2-[4-(dimethylamino)phenyl]acetaldehyde
CID 15114335

Frequently Asked Questions

What is the IUPAC name of 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline (CID 150315249) is 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline is CN(C)c1ccc([SiH](Cc2ccc(Br)cc2)c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline?
The InChIKey is GMLWGHWPTZVVRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27BrN2Si/c1-25(2)20-9-13-22(14-10-20)27(17-18-5-7-19(24)8-6-18)23-15-11-21(12-16-23)26(3)4/h5-16,27H,17H2,1-4H3.
What are the key properties of 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline?
4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline has a molecular weight of 439.47 g/mol, XLogP of 3.70, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-bromophenyl)methyl-[4-(dimethylamino)phenyl]silyl]-N,N-dimethylaniline is sourced from PubChem (CID 150315249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).