3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine

C13H23NO3Si — CID 66744163

IUPAC3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine
SMILESCO[Si](CCCN)(OC)OCCc1ccccc1
InChIInChI=1S/C13H23NO3Si/c1-15-18(16-2,12-6-10-14)17-11-9-13-7-4-3-5-8-13/h3-5,7-8H,6,9-12,14H2,1-2H3
InChIKeyQJQOKVMUICDWRA-UHFFFAOYSA-N
MW269.42 g/mol
LogP1.83
Rot. Bonds9

About 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine

3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine (PubChem CID 66744163) has the molecular formula C13H23NO3Si and a molecular weight of 269.42 g/mol. Its IUPAC name is 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine.

Molecular Properties

Compound Name3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine
PubChem CID66744163
Molecular FormulaC13H23NO3Si
Molecular Weight269.42 g/mol
Exact Mass269.14
IUPAC Name3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine
SMILESCO[Si](CCCN)(OC)OCCc1ccccc1
InChIInChI=1S/C13H23NO3Si/c1-15-18(16-2,12-6-10-14)17-11-9-13-7-4-3-5-8-13/h3-5,7-8H,6,9-12,14H2,1-2H3
InChIKeyQJQOKVMUICDWRA-UHFFFAOYSA-N
XLogP1.83
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.42
LogP ≤ 51.83
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

3-[dimethoxy(phenylmethoxy)silyl]propan-1-amine
CID 66586388
N'-[2-[dimethoxy(2-phenylethyl)silyl]oxyethyl]ethane-1,2-diamine
CID 53427353
[dimethoxy(3-phenylpropoxy)silyl]methanamine
CID 139835551
N'-[3-[dimethoxy(2-phenylethyl)silyl]oxypropyl]ethane-1,2-diamine
CID 66688681
trimethoxy(12-phenyldodecyl)silane
CID 54325157
2-[dimethoxy(2-phenylethyl)silyl]oxyethanethiol
CID 87336831
1-[3-aminopropyl(dimethoxy)silyl]oxy-N-benzylpropan-2-amine
CID 140645888
methanol;toluene;3-trimethoxysilylpropan-1-amine
CID 174567080
N,N-bis(2-phenylethyl)-3-trimethoxysilylpropan-1-amine
CID 141324806
3-[3-aminopropyl(diethoxy)silyl]oxy-1-phenylpentan-3-amine
CID 175434467
trimethoxy(2-phenylethyl)silane;trimethoxy(propyl)silane
CID 70127509
trimethoxy(2-phenylethyl)silane;trimethyl(2-phenylethyl)silane
CID 159040096

Frequently Asked Questions

What is the IUPAC name of 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine?
The IUPAC name of 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine (CID 66744163) is 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine.
What is the SMILES notation for 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine?
The canonical SMILES for 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine is CO[Si](CCCN)(OC)OCCc1ccccc1.
What is the InChIKey of 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine?
The InChIKey is QJQOKVMUICDWRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3Si/c1-15-18(16-2,12-6-10-14)17-11-9-13-7-4-3-5-8-13/h3-5,7-8H,6,9-12,14H2,1-2H3.
What are the key properties of 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine?
3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine has a molecular weight of 269.42 g/mol, XLogP of 1.83, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine is sourced from PubChem (CID 66744163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).