1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine

C12H33NO3Si3 — CID 22491513

IUPAC1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine
SMILESCCC(N([Si](C)(C)C)[Si](C)(C)C)[Si](OC)(OC)OC
InChIInChI=1S/C12H33NO3Si3/c1-11-12(19(14-2,15-3)16-4)13(17(5,6)7)18(8,9)10/h12H,11H2,1-10H3
InChIKeyKQQASGHPGFTUKH-UHFFFAOYSA-N
MW323.66 g/mol
LogP3.15
Rot. Bonds8

About 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine

1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine (PubChem CID 22491513) has the molecular formula C12H33NO3Si3 and a molecular weight of 323.66 g/mol. Its IUPAC name is 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine.

Molecular Properties

Compound Name1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine
PubChem CID22491513
Molecular FormulaC12H33NO3Si3
Molecular Weight323.66 g/mol
Exact Mass323.18
IUPAC Name1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine
SMILESCCC(N([Si](C)(C)C)[Si](C)(C)C)[Si](OC)(OC)OC
InChIInChI=1S/C12H33NO3Si3/c1-11-12(19(14-2,15-3)16-4)13(17(5,6)7)18(8,9)10/h12H,11H2,1-10H3
InChIKeyKQQASGHPGFTUKH-UHFFFAOYSA-N
XLogP3.15
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.66
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine?
The IUPAC name of 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine (CID 22491513) is 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine.
What is the SMILES notation for 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine?
The canonical SMILES for 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine is CCC(N([Si](C)(C)C)[Si](C)(C)C)[Si](OC)(OC)OC.
What is the InChIKey of 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine?
The InChIKey is KQQASGHPGFTUKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H33NO3Si3/c1-11-12(19(14-2,15-3)16-4)13(17(5,6)7)18(8,9)10/h12H,11H2,1-10H3.
What are the key properties of 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine?
1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine has a molecular weight of 323.66 g/mol, XLogP of 3.15, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-trimethoxysilyl-N,N-bis(trimethylsilyl)propan-1-amine is sourced from PubChem (CID 22491513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).