3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine

C17H41NO4Si2 — CID 154169391

IUPAC3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine
SMILESCCOC(OCC)[SiH2]CCCN(C)CCC[SiH2]C(OCC)OCC
InChIInChI=1S/C17H41NO4Si2/c1-6-19-16(20-7-2)23-14-10-12-18(5)13-11-15-24-17(21-8-3)22-9-4/h16-17H,6-15,23-24H2,1-5H3
InChIKeyYMXRPHMIOQYZOO-UHFFFAOYSA-N
MW379.69 g/mol
LogP1.59
Rot. Bonds18

About 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine

3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine (PubChem CID 154169391) has the molecular formula C17H41NO4Si2 and a molecular weight of 379.69 g/mol. Its IUPAC name is 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine
PubChem CID154169391
Molecular FormulaC17H41NO4Si2
Molecular Weight379.69 g/mol
Exact Mass379.26
IUPAC Name3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine
SMILESCCOC(OCC)[SiH2]CCCN(C)CCC[SiH2]C(OCC)OCC
InChIInChI=1S/C17H41NO4Si2/c1-6-19-16(20-7-2)23-14-10-12-18(5)13-11-15-24-17(21-8-3)22-9-4/h16-17H,6-15,23-24H2,1-5H3
InChIKeyYMXRPHMIOQYZOO-UHFFFAOYSA-N
XLogP1.59
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.69
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine?
The IUPAC name of 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine (CID 154169391) is 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine.
What is the SMILES notation for 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine?
The canonical SMILES for 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine is CCOC(OCC)[SiH2]CCCN(C)CCC[SiH2]C(OCC)OCC.
What is the InChIKey of 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine?
The InChIKey is YMXRPHMIOQYZOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H41NO4Si2/c1-6-19-16(20-7-2)23-14-10-12-18(5)13-11-15-24-17(21-8-3)22-9-4/h16-17H,6-15,23-24H2,1-5H3.
What are the key properties of 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine?
3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine has a molecular weight of 379.69 g/mol, XLogP of 1.59, 18 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethoxymethylsilyl)-N-[3-(diethoxymethylsilyl)propyl]-N-methylpropan-1-amine is sourced from PubChem (CID 154169391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).