N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine

C16H37NO4Si — CID 87149238

IUPACN-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine
SMILESCCCO[Si](CCCOC(C)CNC)(OCCC)OCCC
InChIInChI=1S/C16H37NO4Si/c1-6-10-19-22(20-11-7-2,21-12-8-3)14-9-13-18-16(4)15-17-5/h16-17H,6-15H2,1-5H3
InChIKeyNPBGADJIQDWENZ-UHFFFAOYSA-N
MW335.56 g/mol
LogP3.22
Rot. Bonds16

About N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine

N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine (PubChem CID 87149238) has the molecular formula C16H37NO4Si and a molecular weight of 335.56 g/mol. Its IUPAC name is N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine.

Molecular Properties

Compound NameN-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine
PubChem CID87149238
Molecular FormulaC16H37NO4Si
Molecular Weight335.56 g/mol
Exact Mass335.25
IUPAC NameN-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine
SMILESCCCO[Si](CCCOC(C)CNC)(OCCC)OCCC
InChIInChI=1S/C16H37NO4Si/c1-6-10-19-22(20-11-7-2,21-12-8-3)14-9-13-18-16(4)15-17-5/h16-17H,6-15H2,1-5H3
InChIKeyNPBGADJIQDWENZ-UHFFFAOYSA-N
XLogP3.22
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.56
LogP ≤ 53.22
H-Bond Donors ≤ 51
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 N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine?
The IUPAC name of N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine (CID 87149238) is N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine.
What is the SMILES notation for N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine?
The canonical SMILES for N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine is CCCO[Si](CCCOC(C)CNC)(OCCC)OCCC.
What is the InChIKey of N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine?
The InChIKey is NPBGADJIQDWENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H37NO4Si/c1-6-10-19-22(20-11-7-2,21-12-8-3)14-9-13-18-16(4)15-17-5/h16-17H,6-15H2,1-5H3.
What are the key properties of N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine?
N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine has a molecular weight of 335.56 g/mol, XLogP of 3.22, 16 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(3-tripropoxysilylpropoxy)propan-1-amine is sourced from PubChem (CID 87149238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).