1-triethoxysilylpropan-2-amine

C9H23NO3Si — CID 10236113

IUPAC1-triethoxysilylpropan-2-amine
SMILESCCO[Si](CC(C)N)(OCC)OCC
InChIInChI=1S/C9H23NO3Si/c1-5-11-14(12-6-2,13-7-3)8-9(4)10/h9H,5-8,10H2,1-4H3
InChIKeyHXJZEGBVQCRLOD-UHFFFAOYSA-N
MW221.37 g/mol
LogP1.38
Rot. Bonds8

About 1-triethoxysilylpropan-2-amine

1-triethoxysilylpropan-2-amine (PubChem CID 10236113) has the molecular formula C9H23NO3Si and a molecular weight of 221.37 g/mol. Its IUPAC name is 1-triethoxysilylpropan-2-amine.

Molecular Properties

Compound Name1-triethoxysilylpropan-2-amine
PubChem CID10236113
Molecular FormulaC9H23NO3Si
Molecular Weight221.37 g/mol
Exact Mass221.14
IUPAC Name1-triethoxysilylpropan-2-amine
SMILESCCO[Si](CC(C)N)(OCC)OCC
InChIInChI=1S/C9H23NO3Si/c1-5-11-14(12-6-2,13-7-3)8-9(4)10/h9H,5-8,10H2,1-4H3
InChIKeyHXJZEGBVQCRLOD-UHFFFAOYSA-N
XLogP1.38
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-triethoxysilylpropan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-amine
CID 174459396
1-[ethoxy(dimethyl)silyl]propan-2-amine
CID 57130729
triethoxy-(3-ethyl-2-methylpentyl)silane
CID 18696416
(3,4-dichloro-2,5-dimethylhexyl)-triethoxysilane
CID 91420779
3-(triethoxysilylmethyl)heptan-2-amine
CID 23048093
1-triethoxysilylheptan-2-amine
CID 90410833
1-[butan-2-yloxy(dipropoxy)silyl]propan-2-amine
CID 174377064
N-[2-[2-aminopropyl(diethoxy)silyl]oxybutan-2-yl]prop-2-enamide
CID 159339342
N-[3-[2-aminopropyl(diethoxy)silyl]oxybutyl]prop-2-enamide
CID 158029719
3-triethoxysilylpropane-1,2-diol
CID 87668140
1-ethoxy-2-triethoxysilylethanol
CID 87970576
ethoxysilane;N'-(1-triethoxysilylpropan-2-yl)methanediamine
CID 159811606

Frequently Asked Questions

What is the IUPAC name of 1-triethoxysilylpropan-2-amine?
The IUPAC name of 1-triethoxysilylpropan-2-amine (CID 10236113) is 1-triethoxysilylpropan-2-amine.
What is the SMILES notation for 1-triethoxysilylpropan-2-amine?
The canonical SMILES for 1-triethoxysilylpropan-2-amine is CCO[Si](CC(C)N)(OCC)OCC.
What is the InChIKey of 1-triethoxysilylpropan-2-amine?
The InChIKey is HXJZEGBVQCRLOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO3Si/c1-5-11-14(12-6-2,13-7-3)8-9(4)10/h9H,5-8,10H2,1-4H3.
What are the key properties of 1-triethoxysilylpropan-2-amine?
1-triethoxysilylpropan-2-amine has a molecular weight of 221.37 g/mol, XLogP of 1.38, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-triethoxysilylpropan-2-amine is sourced from PubChem (CID 10236113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).