N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide

C16H27NO3Si — CID 150288598

IUPACN-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide
SMILESCCOC(OCC)[SiH2]CCCN(C(C)=O)c1ccccc1
InChIInChI=1S/C16H27NO3Si/c1-4-19-16(20-5-2)21-13-9-12-17(14(3)18)15-10-7-6-8-11-15/h6-8,10-11,16H,4-5,9,12-13,21H2,1-3H3
InChIKeyGHCIKQUUOCPNCP-UHFFFAOYSA-N
MW309.48 g/mol
LogP2.37
Rot. Bonds10

About N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide

N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide (PubChem CID 150288598) has the molecular formula C16H27NO3Si and a molecular weight of 309.48 g/mol. Its IUPAC name is N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide.

Molecular Properties

Compound NameN-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide
PubChem CID150288598
Molecular FormulaC16H27NO3Si
Molecular Weight309.48 g/mol
Exact Mass309.18
IUPAC NameN-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide
SMILESCCOC(OCC)[SiH2]CCCN(C(C)=O)c1ccccc1
InChIInChI=1S/C16H27NO3Si/c1-4-19-16(20-5-2)21-13-9-12-17(14(3)18)15-10-7-6-8-11-15/h6-8,10-11,16H,4-5,9,12-13,21H2,1-3H3
InChIKeyGHCIKQUUOCPNCP-UHFFFAOYSA-N
XLogP2.37
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.48
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide?
The IUPAC name of N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide (CID 150288598) is N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide.
What is the SMILES notation for N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide?
The canonical SMILES for N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide is CCOC(OCC)[SiH2]CCCN(C(C)=O)c1ccccc1.
What is the InChIKey of N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide?
The InChIKey is GHCIKQUUOCPNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO3Si/c1-4-19-16(20-5-2)21-13-9-12-17(14(3)18)15-10-7-6-8-11-15/h6-8,10-11,16H,4-5,9,12-13,21H2,1-3H3.
What are the key properties of N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide?
N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide has a molecular weight of 309.48 g/mol, XLogP of 2.37, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethoxymethylsilyl)propyl]-N-phenylacetamide is sourced from PubChem (CID 150288598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).