N-methyl-N-triethoxysilylmethanamine;hydrate

C8H23NO4Si — CID 172845876

IUPACN-methyl-N-triethoxysilylmethanamine;hydrate
SMILESCCO[Si](OCC)(OCC)N(C)C.O
InChIInChI=1S/C8H21NO3Si.H2O/c1-6-10-13(9(4)5,11-7-2)12-8-3;/h6-8H2,1-5H3;1H2
InChIKeyZVRMTLPLPHNTLT-UHFFFAOYSA-N
MW225.36 g/mol
LogP0.27
Rot. Bonds7

About N-methyl-N-triethoxysilylmethanamine;hydrate

N-methyl-N-triethoxysilylmethanamine;hydrate (PubChem CID 172845876) has the molecular formula C8H23NO4Si and a molecular weight of 225.36 g/mol. Its IUPAC name is N-methyl-N-triethoxysilylmethanamine;hydrate.

Molecular Properties

Compound NameN-methyl-N-triethoxysilylmethanamine;hydrate
PubChem CID172845876
Molecular FormulaC8H23NO4Si
Molecular Weight225.36 g/mol
Exact Mass225.14
IUPAC NameN-methyl-N-triethoxysilylmethanamine;hydrate
SMILESCCO[Si](OCC)(OCC)N(C)C.O
InChIInChI=1S/C8H21NO3Si.H2O/c1-6-10-13(9(4)5,11-7-2)12-8-3;/h6-8H2,1-5H3;1H2
InChIKeyZVRMTLPLPHNTLT-UHFFFAOYSA-N
XLogP0.27
TPSA62.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-methyl-N-triethoxysilylmethanamine;hydrate?
The IUPAC name of N-methyl-N-triethoxysilylmethanamine;hydrate (CID 172845876) is N-methyl-N-triethoxysilylmethanamine;hydrate.
What is the SMILES notation for N-methyl-N-triethoxysilylmethanamine;hydrate?
The canonical SMILES for N-methyl-N-triethoxysilylmethanamine;hydrate is CCO[Si](OCC)(OCC)N(C)C.O.
What is the InChIKey of N-methyl-N-triethoxysilylmethanamine;hydrate?
The InChIKey is ZVRMTLPLPHNTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21NO3Si.H2O/c1-6-10-13(9(4)5,11-7-2)12-8-3;/h6-8H2,1-5H3;1H2.
What are the key properties of N-methyl-N-triethoxysilylmethanamine;hydrate?
N-methyl-N-triethoxysilylmethanamine;hydrate has a molecular weight of 225.36 g/mol, XLogP of 0.27, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-triethoxysilylmethanamine;hydrate is sourced from PubChem (CID 172845876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).