2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride

C12H22ClNSi — CID 22399685

IUPAC2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride
SMILESC[Si](C)(CCN)CCc1ccccc1.Cl
InChIInChI=1S/C12H21NSi.ClH/c1-14(2,11-9-13)10-8-12-6-4-3-5-7-12;/h3-7H,8-11,13H2,1-2H3;1H
InChIKeyNEIUMSFXKKGGJN-UHFFFAOYSA-N
MW243.85 g/mol
LogP3.32
Rot. Bonds5

About 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride

2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride (PubChem CID 22399685) has the molecular formula C12H22ClNSi and a molecular weight of 243.85 g/mol. Its IUPAC name is 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride.

Molecular Properties

Compound Name2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride
PubChem CID22399685
Molecular FormulaC12H22ClNSi
Molecular Weight243.85 g/mol
Exact Mass243.12
IUPAC Name2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride
SMILESC[Si](C)(CCN)CCc1ccccc1.Cl
InChIInChI=1S/C12H21NSi.ClH/c1-14(2,11-9-13)10-8-12-6-4-3-5-7-12;/h3-7H,8-11,13H2,1-2H3;1H
InChIKeyNEIUMSFXKKGGJN-UHFFFAOYSA-N
XLogP3.32
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.85
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride?
The IUPAC name of 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride (CID 22399685) is 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride.
What is the SMILES notation for 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride?
The canonical SMILES for 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride is C[Si](C)(CCN)CCc1ccccc1.Cl.
What is the InChIKey of 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride?
The InChIKey is NEIUMSFXKKGGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NSi.ClH/c1-14(2,11-9-13)10-8-12-6-4-3-5-7-12;/h3-7H,8-11,13H2,1-2H3;1H.
What are the key properties of 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride?
2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride has a molecular weight of 243.85 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dimethyl(2-phenylethyl)silyl]ethanamine;hydrochloride is sourced from PubChem (CID 22399685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).