2-amino-N-(3-triethoxysilylpropyl)acetamide

C11H26N2O4Si — CID 59561209

IUPAC2-amino-N-(3-triethoxysilylpropyl)acetamide
SMILESCCO[Si](CCCNC(=O)CN)(OCC)OCC
InChIInChI=1S/C11H26N2O4Si/c1-4-15-18(16-5-2,17-6-3)9-7-8-13-11(14)10-12/h4-10,12H2,1-3H3,(H,13,14)
InChIKeyNHIUITBLRQDHNL-UHFFFAOYSA-N
MW278.42 g/mol
LogP0.50
Rot. Bonds11

About 2-amino-N-(3-triethoxysilylpropyl)acetamide

2-amino-N-(3-triethoxysilylpropyl)acetamide (PubChem CID 59561209) has the molecular formula C11H26N2O4Si and a molecular weight of 278.42 g/mol. Its IUPAC name is 2-amino-N-(3-triethoxysilylpropyl)acetamide.

Molecular Properties

Compound Name2-amino-N-(3-triethoxysilylpropyl)acetamide
PubChem CID59561209
Molecular FormulaC11H26N2O4Si
Molecular Weight278.42 g/mol
Exact Mass278.17
IUPAC Name2-amino-N-(3-triethoxysilylpropyl)acetamide
SMILESCCO[Si](CCCNC(=O)CN)(OCC)OCC
InChIInChI=1S/C11H26N2O4Si/c1-4-15-18(16-5-2,17-6-3)9-7-8-13-11(14)10-12/h4-10,12H2,1-3H3,(H,13,14)
InChIKeyNHIUITBLRQDHNL-UHFFFAOYSA-N
XLogP0.50
TPSA82.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 50.50
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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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-triethoxysilylpropyl)acetamide?
The IUPAC name of 2-amino-N-(3-triethoxysilylpropyl)acetamide (CID 59561209) is 2-amino-N-(3-triethoxysilylpropyl)acetamide.
What is the SMILES notation for 2-amino-N-(3-triethoxysilylpropyl)acetamide?
The canonical SMILES for 2-amino-N-(3-triethoxysilylpropyl)acetamide is CCO[Si](CCCNC(=O)CN)(OCC)OCC.
What is the InChIKey of 2-amino-N-(3-triethoxysilylpropyl)acetamide?
The InChIKey is NHIUITBLRQDHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O4Si/c1-4-15-18(16-5-2,17-6-3)9-7-8-13-11(14)10-12/h4-10,12H2,1-3H3,(H,13,14).
What are the key properties of 2-amino-N-(3-triethoxysilylpropyl)acetamide?
2-amino-N-(3-triethoxysilylpropyl)acetamide has a molecular weight of 278.42 g/mol, XLogP of 0.50, 11 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-triethoxysilylpropyl)acetamide is sourced from PubChem (CID 59561209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).