3-[diphenoxy(phenyl)silyl]propan-1-amine

C21H23NO2Si — CID 139775070

IUPAC3-[diphenoxy(phenyl)silyl]propan-1-amine
SMILESNCCC[Si](Oc1ccccc1)(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NO2Si/c22-17-10-18-25(21-15-8-3-9-16-21,23-19-11-4-1-5-12-19)24-20-13-6-2-7-14-20/h1-9,11-16H,10,17-18,22H2
InChIKeyWLYFQTGGEQUEEX-UHFFFAOYSA-N
MW349.51 g/mol
LogP3.84
Rot. Bonds8

About 3-[diphenoxy(phenyl)silyl]propan-1-amine

3-[diphenoxy(phenyl)silyl]propan-1-amine (PubChem CID 139775070) has the molecular formula C21H23NO2Si and a molecular weight of 349.51 g/mol. Its IUPAC name is 3-[diphenoxy(phenyl)silyl]propan-1-amine.

Molecular Properties

Compound Name3-[diphenoxy(phenyl)silyl]propan-1-amine
PubChem CID139775070
Molecular FormulaC21H23NO2Si
Molecular Weight349.51 g/mol
Exact Mass349.15
IUPAC Name3-[diphenoxy(phenyl)silyl]propan-1-amine
SMILESNCCC[Si](Oc1ccccc1)(Oc1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NO2Si/c22-17-10-18-25(21-15-8-3-9-16-21,23-19-11-4-1-5-12-19)24-20-13-6-2-7-14-20/h1-9,11-16H,10,17-18,22H2
InChIKeyWLYFQTGGEQUEEX-UHFFFAOYSA-N
XLogP3.84
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.51
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[phenyl-bis(2,2,2-trifluoroethoxy)silyl]propan-1-amine
CID 54356096
[acetyloxy-(3-aminopropyl)-phenylsilyl] acetate
CID 90098236
3-[hydroxy(diphenyl)silyl]propan-1-amine
CID 164773913
3-[[(3-aminopropyl-methyl-phenylsilyl)oxy-diphenylsilyl]oxy-methyl-phenylsilyl]propan-1-amine
CID 140662056
phenoxy-diphenyl-propylsilane
CID 66773867
3-[bis(3-aminopropoxy)-phenylsilyl]oxypropan-1-amine
CID 154134057
[[aminomethyl(dimethyl)silyl]oxy-dimethylsilyl]methanamine;3-[(3-aminopropyl-methyl-phenylsilyl)oxy-methyl-phenylsilyl]propan-1-amine
CID 91258394
triphenyl-(4-triphenylsilyloxyphenoxy)silane
CID 86209033
2-[phenyl(dipropoxy)silyl]ethanamine
CID 141216090
methanol;toluene;3-trimethoxysilylpropan-1-amine
CID 174567080
phenylperoxymethanamine
CID 163956445
3-(4-phenoxybutoxy)propan-1-amine
CID 82352658

Frequently Asked Questions

What is the IUPAC name of 3-[diphenoxy(phenyl)silyl]propan-1-amine?
The IUPAC name of 3-[diphenoxy(phenyl)silyl]propan-1-amine (CID 139775070) is 3-[diphenoxy(phenyl)silyl]propan-1-amine.
What is the SMILES notation for 3-[diphenoxy(phenyl)silyl]propan-1-amine?
The canonical SMILES for 3-[diphenoxy(phenyl)silyl]propan-1-amine is NCCC[Si](Oc1ccccc1)(Oc1ccccc1)c1ccccc1.
What is the InChIKey of 3-[diphenoxy(phenyl)silyl]propan-1-amine?
The InChIKey is WLYFQTGGEQUEEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NO2Si/c22-17-10-18-25(21-15-8-3-9-16-21,23-19-11-4-1-5-12-19)24-20-13-6-2-7-14-20/h1-9,11-16H,10,17-18,22H2.
What are the key properties of 3-[diphenoxy(phenyl)silyl]propan-1-amine?
3-[diphenoxy(phenyl)silyl]propan-1-amine has a molecular weight of 349.51 g/mol, XLogP of 3.84, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[diphenoxy(phenyl)silyl]propan-1-amine is sourced from PubChem (CID 139775070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).