N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide

C22H31NO3Si — CID 69025615

IUPACN-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide
SMILESCC(C)(C)[Si](OCCNC(=O)CCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H31NO3Si/c1-22(2,3)27(19-11-6-4-7-12-19,20-13-8-5-9-14-20)26-18-16-23-21(25)15-10-17-24/h4-9,11-14,24H,10,15-18H2,1-3H3,(H,23,25)
InChIKeyTVDHHCUWOSEVCQ-UHFFFAOYSA-N
MW385.58 g/mol
LogP2.45
Rot. Bonds9

About N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide

N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide (PubChem CID 69025615) has the molecular formula C22H31NO3Si and a molecular weight of 385.58 g/mol. Its IUPAC name is N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide.

Molecular Properties

Compound NameN-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide
PubChem CID69025615
Molecular FormulaC22H31NO3Si
Molecular Weight385.58 g/mol
Exact Mass385.21
IUPAC NameN-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide
SMILESCC(C)(C)[Si](OCCNC(=O)CCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H31NO3Si/c1-22(2,3)27(19-11-6-4-7-12-19,20-13-8-5-9-14-20)26-18-16-23-21(25)15-10-17-24/h4-9,11-14,24H,10,15-18H2,1-3H3,(H,23,25)
InChIKeyTVDHHCUWOSEVCQ-UHFFFAOYSA-N
XLogP2.45
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.58
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide 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 N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide?
The IUPAC name of N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide (CID 69025615) is N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide.
What is the SMILES notation for N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide?
The canonical SMILES for N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide is CC(C)(C)[Si](OCCNC(=O)CCCO)(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide?
The InChIKey is TVDHHCUWOSEVCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H31NO3Si/c1-22(2,3)27(19-11-6-4-7-12-19,20-13-8-5-9-14-20)26-18-16-23-21(25)15-10-17-24/h4-9,11-14,24H,10,15-18H2,1-3H3,(H,23,25).
What are the key properties of N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide?
N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide has a molecular weight of 385.58 g/mol, XLogP of 2.45, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[tert-butyl(diphenyl)silyl]oxyethyl]-4-hydroxybutanamide is sourced from PubChem (CID 69025615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).