(2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide

C12H20N2O2Si — CID 167723544

IUPAC(2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide
SMILESC[Si](C)(C)Oc1ccc(C[C@H](N)C(N)=O)cc1
InChIInChI=1S/C12H20N2O2Si/c1-17(2,3)16-10-6-4-9(5-7-10)8-11(13)12(14)15/h4-7,11H,8,13H2,1-3H3,(H2,14,15)/t11-/m0/s1
InChIKeyKVLBEHGIHADGTP-NSHDSACASA-N
MW252.39 g/mol
LogP1.26
Rot. Bonds5

About (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide

(2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide (PubChem CID 167723544) has the molecular formula C12H20N2O2Si and a molecular weight of 252.39 g/mol. Its IUPAC name is (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide
PubChem CID167723544
Molecular FormulaC12H20N2O2Si
Molecular Weight252.39 g/mol
Exact Mass252.13
IUPAC Name(2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide
SMILESC[Si](C)(C)Oc1ccc(C[C@H](N)C(N)=O)cc1
InChIInChI=1S/C12H20N2O2Si/c1-17(2,3)16-10-6-4-9(5-7-10)8-11(13)12(14)15/h4-7,11H,8,13H2,1-3H3,(H2,14,15)/t11-/m0/s1
InChIKeyKVLBEHGIHADGTP-NSHDSACASA-N
XLogP1.26
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.39
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide 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-amino-3-(4-methylphenyl)propanamide
CID 18981163
2-[4-[(2S)-2,3-diamino-3-oxopropyl]phenoxy]acetic acid
CID 170184313
(2R)-2-amino-3-(4-hydroxyphenyl)propanamide
CID 10511575
2-amino-3-(4-propan-2-ylphenyl)propanamide
CID 64990650
[4-[(2S)-2,3-diamino-3-oxopropyl]phenyl] trifluoromethanesulfonate
CID 175201724
[4-(2,3-diamino-3-oxopropyl)phenyl] hydrogen phosphate
CID 59010907
2-amino-3-(4-hydroxyphenyl)propanamide;hydrobromide
CID 174991066
[amino-[4-[(2R)-2,3-diamino-3-oxopropyl]phenyl]methylidene]azanium
CID 16740996
cobalt(2+);4-[(2S)-2,3-diamino-3-oxopropyl]phenolate;hydrogen carbonate
CID 11500383
[tert-butyl(dimethyl)silyl] 2-amino-3-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenoxy]phenyl]propanoate
CID 91742096
2-amino-3-(4-butan-2-ylphenyl)propanamide
CID 116850831
2-amino-3-(3,4-dimethoxyphenyl)propanamide
CID 14132751

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide?
The IUPAC name of (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide (CID 167723544) is (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide.
What is the SMILES notation for (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide?
The canonical SMILES for (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide is C[Si](C)(C)Oc1ccc(C[C@H](N)C(N)=O)cc1.
What is the InChIKey of (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide?
The InChIKey is KVLBEHGIHADGTP-NSHDSACASA-N. The full InChI is InChI=1S/C12H20N2O2Si/c1-17(2,3)16-10-6-4-9(5-7-10)8-11(13)12(14)15/h4-7,11H,8,13H2,1-3H3,(H2,14,15)/t11-/m0/s1.
What are the key properties of (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide?
(2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide has a molecular weight of 252.39 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-3-(4-trimethylsilyloxyphenyl)propanamide is sourced from PubChem (CID 167723544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).