3-ethyl-3-triethoxysilylpentan-1-amine

C13H31NO3Si — CID 23083469

IUPAC3-ethyl-3-triethoxysilylpentan-1-amine
SMILESCCO[Si](OCC)(OCC)C(CC)(CC)CCN
InChIInChI=1S/C13H31NO3Si/c1-6-13(7-2,11-12-14)18(15-8-3,16-9-4)17-10-5/h6-12,14H2,1-5H3
InChIKeyWWALDPOXLAIMRS-UHFFFAOYSA-N
MW277.48 g/mol
LogP2.94
Rot. Bonds11

About 3-ethyl-3-triethoxysilylpentan-1-amine

3-ethyl-3-triethoxysilylpentan-1-amine (PubChem CID 23083469) has the molecular formula C13H31NO3Si and a molecular weight of 277.48 g/mol. Its IUPAC name is 3-ethyl-3-triethoxysilylpentan-1-amine.

Molecular Properties

Compound Name3-ethyl-3-triethoxysilylpentan-1-amine
PubChem CID23083469
Molecular FormulaC13H31NO3Si
Molecular Weight277.48 g/mol
Exact Mass277.21
IUPAC Name3-ethyl-3-triethoxysilylpentan-1-amine
SMILESCCO[Si](OCC)(OCC)C(CC)(CC)CCN
InChIInChI=1S/C13H31NO3Si/c1-6-13(7-2,11-12-14)18(15-8-3,16-9-4)17-10-5/h6-12,14H2,1-5H3
InChIKeyWWALDPOXLAIMRS-UHFFFAOYSA-N
XLogP2.94
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.48
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

triethoxy(3-ethylhexan-3-yl)silane
CID 175030722
4-(oxiran-2-ylmethoxy)-3-(oxiran-2-ylmethoxymethyl)-3-triethoxysilylbutan-1-amine
CID 175533703
3-[dimethoxy(methyl)silyl]-3-ethylpentan-1-amine
CID 54410640
4-triethoxysilylheptane-1,4-diamine
CID 91551145
(2-ethyl-2-triethoxysilylbutyl)-oxido-oxophosphanium
CID 175037304
triethoxy(2-triethoxysilylpropan-2-yl)silane
CID 18432084
ethane-1,2-diamine;triethoxy(methyl)silane
CID 158658037
(2-propyl-2-triethoxysilylpentyl)phosphonic acid
CID 174895590
(3-methyl-3-triethoxysilylbutyl)phosphane
CID 174985696
3,3-diethylhexane-1,6-diamine
CID 89464851
triethoxy(2,3,3-trimethylbutan-2-yl)silane
CID 18000011
butyl(triethoxy)silane;tert-butyl(triethoxy)silane
CID 175188929

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-triethoxysilylpentan-1-amine?
The IUPAC name of 3-ethyl-3-triethoxysilylpentan-1-amine (CID 23083469) is 3-ethyl-3-triethoxysilylpentan-1-amine.
What is the SMILES notation for 3-ethyl-3-triethoxysilylpentan-1-amine?
The canonical SMILES for 3-ethyl-3-triethoxysilylpentan-1-amine is CCO[Si](OCC)(OCC)C(CC)(CC)CCN.
What is the InChIKey of 3-ethyl-3-triethoxysilylpentan-1-amine?
The InChIKey is WWALDPOXLAIMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NO3Si/c1-6-13(7-2,11-12-14)18(15-8-3,16-9-4)17-10-5/h6-12,14H2,1-5H3.
What are the key properties of 3-ethyl-3-triethoxysilylpentan-1-amine?
3-ethyl-3-triethoxysilylpentan-1-amine has a molecular weight of 277.48 g/mol, XLogP of 2.94, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-triethoxysilylpentan-1-amine is sourced from PubChem (CID 23083469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).