3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine

C16H31NO2Si2 — CID 175152153

IUPAC3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine
SMILESCCO[Si](C)(CCCN)OC(C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C16H31NO2Si2/c1-6-18-21(5,14-10-13-17)19-15(2)20(3,4)16-11-8-7-9-12-16/h7-9,11-12,15H,6,10,13-14,17H2,1-5H3
InChIKeyJMKVLQXKRXZHNT-UHFFFAOYSA-N
MW325.60 g/mol
LogP3.00
Rot. Bonds9

About 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine

3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine (PubChem CID 175152153) has the molecular formula C16H31NO2Si2 and a molecular weight of 325.60 g/mol. Its IUPAC name is 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine.

Molecular Properties

Compound Name3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine
PubChem CID175152153
Molecular FormulaC16H31NO2Si2
Molecular Weight325.60 g/mol
Exact Mass325.19
IUPAC Name3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine
SMILESCCO[Si](C)(CCCN)OC(C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C16H31NO2Si2/c1-6-18-21(5,14-10-13-17)19-15(2)20(3,4)16-11-8-7-9-12-16/h7-9,11-12,15H,6,10,13-14,17H2,1-5H3
InChIKeyJMKVLQXKRXZHNT-UHFFFAOYSA-N
XLogP3.00
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.60
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine?
The IUPAC name of 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine (CID 175152153) is 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine.
What is the SMILES notation for 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine?
The canonical SMILES for 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine is CCO[Si](C)(CCCN)OC(C)[Si](C)(C)c1ccccc1.
What is the InChIKey of 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine?
The InChIKey is JMKVLQXKRXZHNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2Si2/c1-6-18-21(5,14-10-13-17)19-15(2)20(3,4)16-11-8-7-9-12-16/h7-9,11-12,15H,6,10,13-14,17H2,1-5H3.
What are the key properties of 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine?
3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine has a molecular weight of 325.60 g/mol, XLogP of 3.00, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[dimethyl(phenyl)silyl]ethoxy-ethoxy-methylsilyl]propan-1-amine is sourced from PubChem (CID 175152153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).