N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline

C32H29NSi — CID 132609803

IUPACN-[(1S)-1-phenylethyl]-N-triphenylsilylaniline
SMILESC[C@@H](c1ccccc1)N(c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H29NSi/c1-27(28-17-7-2-8-18-28)33(29-19-9-3-10-20-29)34(30-21-11-4-12-22-30,31-23-13-5-14-24-31)32-25-15-6-16-26-32/h2-27H,1H3/t27-/m0/s1
InChIKeyHGXGDWXJJSMRKB-MHZLTWQESA-N
MW455.68 g/mol
LogP5.92
Rot. Bonds7

About N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline

N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline (PubChem CID 132609803) has the molecular formula C32H29NSi and a molecular weight of 455.68 g/mol. Its IUPAC name is N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline.

Molecular Properties

Compound NameN-[(1S)-1-phenylethyl]-N-triphenylsilylaniline
PubChem CID132609803
Molecular FormulaC32H29NSi
Molecular Weight455.68 g/mol
Exact Mass455.21
IUPAC NameN-[(1S)-1-phenylethyl]-N-triphenylsilylaniline
SMILESC[C@@H](c1ccccc1)N(c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C32H29NSi/c1-27(28-17-7-2-8-18-28)33(29-19-9-3-10-20-29)34(30-21-11-4-12-22-30,31-23-13-5-14-24-31)32-25-15-6-16-26-32/h2-27H,1H3/t27-/m0/s1
InChIKeyHGXGDWXJJSMRKB-MHZLTWQESA-N
XLogP5.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500455.68
LogP ≤ 55.92
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 N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline 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

(1R)-1-phenyl-N,N-bis[(1R)-1-phenylethyl]ethanamine;(1S)-1-phenyl-N,N-bis[(1S)-1-phenylethyl]ethanamine
CID 139197887
CID 100998322
CID 100998322
N-[(1S)-1-phenylethyl]-N-[(N-[(1S)-1-phenylethyl]anilino)disulfanyl]aniline
CID 59444440
(1S)-N,N-dimethyl-1-phenylethanamine
CID 2724276
N-(1-chloroethyl)-N-(1-phenylethyl)aniline
CID 21396778
N-methyl-N-[(1S)-1-phenylethyl]pyridin-3-amine
CID 124632027
(1S)-N,N-dimethyl-1-phenylethanamine;hydrochloride
CID 141121906
4-N-phenyl-4-N-(1-phenylethyl)benzene-1,4-diamine
CID 67775594
(2R,3R)-2-N,2-N,3-N,3-N-tetraphenylbutane-2,3-diamine
CID 139888641
(1R)-N-methanidyl-N-methyl-1-phenylethanamine
CID 59297896
ethane;[(2S)-3-phenylbutan-2-yl]benzene
CID 143602107
4-methyl-N-[(1R)-1-phenylethyl]-N-[(1S)-1-phenylethyl]aniline
CID 50900534

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline?
The IUPAC name of N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline (CID 132609803) is N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline.
What is the SMILES notation for N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline?
The canonical SMILES for N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline is C[C@@H](c1ccccc1)N(c1ccccc1)[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline?
The InChIKey is HGXGDWXJJSMRKB-MHZLTWQESA-N. The full InChI is InChI=1S/C32H29NSi/c1-27(28-17-7-2-8-18-28)33(29-19-9-3-10-20-29)34(30-21-11-4-12-22-30,31-23-13-5-14-24-31)32-25-15-6-16-26-32/h2-27H,1H3/t27-/m0/s1.
What are the key properties of N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline?
N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline has a molecular weight of 455.68 g/mol, XLogP of 5.92, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-phenylethyl]-N-triphenylsilylaniline is sourced from PubChem (CID 132609803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).