6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide

C20H43NO5Si — CID 90014930

IUPAC6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide
SMILESCCCCCC(O)CCCCC(=O)NCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C20H43NO5Si/c1-5-9-10-14-19(22)15-11-12-16-20(23)21-17-13-18-27(24-6-2,25-7-3)26-8-4/h19,22H,5-18H2,1-4H3,(H,21,23)
InChIKeyDPBPUCBNQBEAIB-UHFFFAOYSA-N
MW405.65 g/mol
LogP4.04
Rot. Bonds19

About 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide

6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide (PubChem CID 90014930) has the molecular formula C20H43NO5Si and a molecular weight of 405.65 g/mol. Its IUPAC name is 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide.

Molecular Properties

Compound Name6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide
PubChem CID90014930
Molecular FormulaC20H43NO5Si
Molecular Weight405.65 g/mol
Exact Mass405.29
IUPAC Name6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide
SMILESCCCCCC(O)CCCCC(=O)NCCC[Si](OCC)(OCC)OCC
InChIInChI=1S/C20H43NO5Si/c1-5-9-10-14-19(22)15-11-12-16-20(23)21-17-13-18-27(24-6-2,25-7-3)26-8-4/h19,22H,5-18H2,1-4H3,(H,21,23)
InChIKeyDPBPUCBNQBEAIB-UHFFFAOYSA-N
XLogP4.04
TPSA77.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds19
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.65
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-hydroxy-N-(3-triethoxysilylpropyl)decanamide
CID 90014913
N-(3-triethoxysilylpropyl)hexanamide
CID 71321496
7-hydroxy-N-octadecyloctadecanamide
CID 57160535
N-(3-triethoxysilylpropyl)butanamide
CID 20829613
7-hydroxy-N-[2-(7-hydroxyoctadecanoylamino)ethyl]octadecanamide
CID 57266771
N-deuterio-N-(3-triethoxysilylpropyl)octadecanamide
CID 175949484
N-(16-hydroxyoctadecyl)decanamide
CID 90886549
N-(3-trimethoxysilylpropyl)tricosanamide
CID 175992989
N-(3-trimethoxysilylpropyl)octanamide
CID 71362207
1-octyl-3-(3-triethoxysilylpropyl)urea
CID 102048521
3-(12-hydroxyoctadecanoylamino)-N,N-dimethylpropan-1-amine oxide
CID 87400028
2-amino-N-(3-triethoxysilylpropyl)acetamide
CID 59561209

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide?
The IUPAC name of 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide (CID 90014930) is 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide.
What is the SMILES notation for 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide?
The canonical SMILES for 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide is CCCCCC(O)CCCCC(=O)NCCC[Si](OCC)(OCC)OCC.
What is the InChIKey of 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide?
The InChIKey is DPBPUCBNQBEAIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H43NO5Si/c1-5-9-10-14-19(22)15-11-12-16-20(23)21-17-13-18-27(24-6-2,25-7-3)26-8-4/h19,22H,5-18H2,1-4H3,(H,21,23).
What are the key properties of 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide?
6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide has a molecular weight of 405.65 g/mol, XLogP of 4.04, 19 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-N-(3-triethoxysilylpropyl)undecanamide is sourced from PubChem (CID 90014930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).