3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate

C12H33NO6Si2 — CID 160657571

IUPAC3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate
SMILESCCO[Si](C)(CCCN)OCC.CO[Si](OC)(OC)OC
InChIInChI=1S/C8H21NO2Si.C4H12O4Si/c1-4-10-12(3,11-5-2)8-6-7-9;1-5-9(6-2,7-3)8-4/h4-9H2,1-3H3;1-4H3
InChIKeyRLGCEIUPFWSWEP-UHFFFAOYSA-N
MW343.57 g/mol
LogP1.49
Rot. Bonds11

About 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate

3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate (PubChem CID 160657571) has the molecular formula C12H33NO6Si2 and a molecular weight of 343.57 g/mol. Its IUPAC name is 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate.

Molecular Properties

Compound Name3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate
PubChem CID160657571
Molecular FormulaC12H33NO6Si2
Molecular Weight343.57 g/mol
Exact Mass343.18
IUPAC Name3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate
SMILESCCO[Si](C)(CCCN)OCC.CO[Si](OC)(OC)OC
InChIInChI=1S/C8H21NO2Si.C4H12O4Si/c1-4-10-12(3,11-5-2)8-6-7-9;1-5-9(6-2,7-3)8-4/h4-9H2,1-3H3;1-4H3
InChIKeyRLGCEIUPFWSWEP-UHFFFAOYSA-N
XLogP1.49
TPSA81.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.57
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate?
The IUPAC name of 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate (CID 160657571) is 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate.
What is the SMILES notation for 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate?
The canonical SMILES for 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate is CCO[Si](C)(CCCN)OCC.CO[Si](OC)(OC)OC.
What is the InChIKey of 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate?
The InChIKey is RLGCEIUPFWSWEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21NO2Si.C4H12O4Si/c1-4-10-12(3,11-5-2)8-6-7-9;1-5-9(6-2,7-3)8-4/h4-9H2,1-3H3;1-4H3.
What are the key properties of 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate?
3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate has a molecular weight of 343.57 g/mol, XLogP of 1.49, 11 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[diethoxy(methyl)silyl]propan-1-amine;tetramethyl silicate is sourced from PubChem (CID 160657571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).