N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane

C11H33NO6SSi — CID 174056869

IUPACN-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane
SMILESCCC.CCCS(=O)(=O)O.CNC.CO[SiH](OC)OC
InChIInChI=1S/C3H8O3S.C3H10O3Si.C3H8.C2H7N/c1-2-3-7(4,5)6;1-4-7(5-2)6-3;2*1-3-2/h2-3H2,1H3,(H,4,5,6);7H,1-3H3;3H2,1-2H3;3H,1-2H3
InChIKeyDEKQCOLKXPVFCV-UHFFFAOYSA-N
MW335.54 g/mol
LogP1.18
Rot. Bonds5

About N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane

N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane (PubChem CID 174056869) has the molecular formula C11H33NO6SSi and a molecular weight of 335.54 g/mol. Its IUPAC name is N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane.

Molecular Properties

Compound NameN-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane
PubChem CID174056869
Molecular FormulaC11H33NO6SSi
Molecular Weight335.54 g/mol
Exact Mass335.18
IUPAC NameN-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane
SMILESCCC.CCCS(=O)(=O)O.CNC.CO[SiH](OC)OC
InChIInChI=1S/C3H8O3S.C3H10O3Si.C3H8.C2H7N/c1-2-3-7(4,5)6;1-4-7(5-2)6-3;2*1-3-2/h2-3H2,1H3,(H,4,5,6);7H,1-3H3;3H2,1-2H3;3H,1-2H3
InChIKeyDEKQCOLKXPVFCV-UHFFFAOYSA-N
XLogP1.18
TPSA94.09 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.54
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane?
The IUPAC name of N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane (CID 174056869) is N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane.
What is the SMILES notation for N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane?
The canonical SMILES for N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane is CCC.CCCS(=O)(=O)O.CNC.CO[SiH](OC)OC.
What is the InChIKey of N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane?
The InChIKey is DEKQCOLKXPVFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8O3S.C3H10O3Si.C3H8.C2H7N/c1-2-3-7(4,5)6;1-4-7(5-2)6-3;2*1-3-2/h2-3H2,1H3,(H,4,5,6);7H,1-3H3;3H2,1-2H3;3H,1-2H3.
What are the key properties of N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane?
N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane has a molecular weight of 335.54 g/mol, XLogP of 1.18, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylmethanamine;propane;propane-1-sulfonic acid;trimethoxysilane is sourced from PubChem (CID 174056869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).