3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine

C9H28N2O3Si2 — CID 158758636

IUPAC3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine
SMILESCO[Si](CCCN)(OC)OC.NCCC[SiH3]
InChIInChI=1S/C6H17NO3Si.C3H11NSi/c1-8-11(9-2,10-3)6-4-5-7;4-2-1-3-5/h4-7H2,1-3H3;1-4H2,5H3
InChIKeyIOJSCWLZUZCFNS-UHFFFAOYSA-N
MW268.51 g/mol
LogP-0.67
Rot. Bonds8

About 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine

3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine (PubChem CID 158758636) has the molecular formula C9H28N2O3Si2 and a molecular weight of 268.51 g/mol. Its IUPAC name is 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine.

Molecular Properties

Compound Name3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine
PubChem CID158758636
Molecular FormulaC9H28N2O3Si2
Molecular Weight268.51 g/mol
Exact Mass268.16
IUPAC Name3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine
SMILESCO[Si](CCCN)(OC)OC.NCCC[SiH3]
InChIInChI=1S/C6H17NO3Si.C3H11NSi/c1-8-11(9-2,10-3)6-4-5-7;4-2-1-3-5/h4-7H2,1-3H3;1-4H2,5H3
InChIKeyIOJSCWLZUZCFNS-UHFFFAOYSA-N
XLogP-0.67
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.51
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
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 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine?
The IUPAC name of 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine (CID 158758636) is 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine.
What is the SMILES notation for 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine?
The canonical SMILES for 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine is CO[Si](CCCN)(OC)OC.NCCC[SiH3].
What is the InChIKey of 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine?
The InChIKey is IOJSCWLZUZCFNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17NO3Si.C3H11NSi/c1-8-11(9-2,10-3)6-4-5-7;4-2-1-3-5/h4-7H2,1-3H3;1-4H2,5H3.
What are the key properties of 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine?
3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine has a molecular weight of 268.51 g/mol, XLogP of -0.67, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-silylpropan-1-amine;3-trimethoxysilylpropan-1-amine is sourced from PubChem (CID 158758636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).