N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine

C15H28N2O3Si — CID 15143396

IUPACN-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine
SMILESCCO[Si](CCCN(C)c1ccncc1)(OCC)OCC
InChIInChI=1S/C15H28N2O3Si/c1-5-18-21(19-6-2,20-7-3)14-8-13-17(4)15-9-11-16-12-10-15/h9-12H,5-8,13-14H2,1-4H3
InChIKeyOLHCOFOKTCJRLU-UHFFFAOYSA-N
MW312.49 g/mol
LogP2.96
Rot. Bonds11

About N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine

N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine (PubChem CID 15143396) has the molecular formula C15H28N2O3Si and a molecular weight of 312.49 g/mol. Its IUPAC name is N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine.

Molecular Properties

Compound NameN-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine
PubChem CID15143396
Molecular FormulaC15H28N2O3Si
Molecular Weight312.49 g/mol
Exact Mass312.19
IUPAC NameN-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine
SMILESCCO[Si](CCCN(C)c1ccncc1)(OCC)OCC
InChIInChI=1S/C15H28N2O3Si/c1-5-18-21(19-6-2,20-7-3)14-8-13-17(4)15-9-11-16-12-10-15/h9-12H,5-8,13-14H2,1-4H3
InChIKeyOLHCOFOKTCJRLU-UHFFFAOYSA-N
XLogP2.96
TPSA43.82 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.49
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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-(3-triethoxysilylpropyl)pyridin-4-amine?
The IUPAC name of N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine (CID 15143396) is N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine.
What is the SMILES notation for N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine?
The canonical SMILES for N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine is CCO[Si](CCCN(C)c1ccncc1)(OCC)OCC.
What is the InChIKey of N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine?
The InChIKey is OLHCOFOKTCJRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O3Si/c1-5-18-21(19-6-2,20-7-3)14-8-13-17(4)15-9-11-16-12-10-15/h9-12H,5-8,13-14H2,1-4H3.
What are the key properties of N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine?
N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine has a molecular weight of 312.49 g/mol, XLogP of 2.96, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(3-triethoxysilylpropyl)pyridin-4-amine is sourced from PubChem (CID 15143396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).