N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide

C21H29NO3Si — CID 155648170

IUPACN-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide
SMILESCC(=O)NC(CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C21H29NO3Si/c1-17(24)22-18(15-23)16-25-26(21(2,3)4,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,18,23H,15-16H2,1-4H3,(H,22,24)
InChIKeySVNFERMGZVYLCX-UHFFFAOYSA-N
MW371.55 g/mol
LogP2.06
Rot. Bonds7

About N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide

N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide (PubChem CID 155648170) has the molecular formula C21H29NO3Si and a molecular weight of 371.55 g/mol. Its IUPAC name is N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide.

Molecular Properties

Compound NameN-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide
PubChem CID155648170
Molecular FormulaC21H29NO3Si
Molecular Weight371.55 g/mol
Exact Mass371.19
IUPAC NameN-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide
SMILESCC(=O)NC(CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C21H29NO3Si/c1-17(24)22-18(15-23)16-25-26(21(2,3)4,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,18,23H,15-16H2,1-4H3,(H,22,24)
InChIKeySVNFERMGZVYLCX-UHFFFAOYSA-N
XLogP2.06
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.55
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide?
The IUPAC name of N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide (CID 155648170) is N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide.
What is the SMILES notation for N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide?
The canonical SMILES for N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide is CC(=O)NC(CO)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide?
The InChIKey is SVNFERMGZVYLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29NO3Si/c1-17(24)22-18(15-23)16-25-26(21(2,3)4,19-11-7-5-8-12-19)20-13-9-6-10-14-20/h5-14,18,23H,15-16H2,1-4H3,(H,22,24).
What are the key properties of N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide?
N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide has a molecular weight of 371.55 g/mol, XLogP of 2.06, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[tert-butyl(diphenyl)silyl]oxy-3-hydroxypropan-2-yl]acetamide is sourced from PubChem (CID 155648170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).