3-triphenylsilylpropan-1-amine;hydrochloride

C21H24ClNSi — CID 3050466

IUPAC3-triphenylsilylpropan-1-amine;hydrochloride
SMILESCl.NCCC[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NSi.ClH/c22-17-10-18-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21;/h1-9,11-16H,10,17-18,22H2;1H
InChIKeyYIPWSYRPBRTCPH-UHFFFAOYSA-N
MW353.97 g/mol
LogP2.93
Rot. Bonds6

About 3-triphenylsilylpropan-1-amine;hydrochloride

3-triphenylsilylpropan-1-amine;hydrochloride (PubChem CID 3050466) has the molecular formula C21H24ClNSi and a molecular weight of 353.97 g/mol. Its IUPAC name is 3-triphenylsilylpropan-1-amine;hydrochloride.

Molecular Properties

Compound Name3-triphenylsilylpropan-1-amine;hydrochloride
PubChem CID3050466
Molecular FormulaC21H24ClNSi
Molecular Weight353.97 g/mol
Exact Mass353.14
IUPAC Name3-triphenylsilylpropan-1-amine;hydrochloride
SMILESCl.NCCC[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H23NSi.ClH/c22-17-10-18-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21;/h1-9,11-16H,10,17-18,22H2;1H
InChIKeyYIPWSYRPBRTCPH-UHFFFAOYSA-N
XLogP2.93
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.97
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-triphenylsilylpropan-1-amine;hydrochloride?
The IUPAC name of 3-triphenylsilylpropan-1-amine;hydrochloride (CID 3050466) is 3-triphenylsilylpropan-1-amine;hydrochloride.
What is the SMILES notation for 3-triphenylsilylpropan-1-amine;hydrochloride?
The canonical SMILES for 3-triphenylsilylpropan-1-amine;hydrochloride is Cl.NCCC[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-triphenylsilylpropan-1-amine;hydrochloride?
The InChIKey is YIPWSYRPBRTCPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23NSi.ClH/c22-17-10-18-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)21-15-8-3-9-16-21;/h1-9,11-16H,10,17-18,22H2;1H.
What are the key properties of 3-triphenylsilylpropan-1-amine;hydrochloride?
3-triphenylsilylpropan-1-amine;hydrochloride has a molecular weight of 353.97 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-triphenylsilylpropan-1-amine;hydrochloride is sourced from PubChem (CID 3050466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).