(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride

C11H28ClNOSi — CID 50999200

IUPAC(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride
SMILESCC(C)[C@@H](N)CO[Si](C)(C)C(C)(C)C.Cl
InChIInChI=1S/C11H27NOSi.ClH/c1-9(2)10(12)8-13-14(6,7)11(3,4)5;/h9-10H,8,12H2,1-7H3;1H/t10-;/m0./s1
InChIKeyMKINDFMDNPVXCE-PPHPATTJSA-N
MW253.89 g/mol
LogP3.41
Rot. Bonds4

About (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride

(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride (PubChem CID 50999200) has the molecular formula C11H28ClNOSi and a molecular weight of 253.89 g/mol. Its IUPAC name is (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride.

Molecular Properties

Compound Name(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride
PubChem CID50999200
Molecular FormulaC11H28ClNOSi
Molecular Weight253.89 g/mol
Exact Mass253.16
IUPAC Name(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride
SMILESCC(C)[C@@H](N)CO[Si](C)(C)C(C)(C)C.Cl
InChIInChI=1S/C11H27NOSi.ClH/c1-9(2)10(12)8-13-14(6,7)11(3,4)5;/h9-10H,8,12H2,1-7H3;1H/t10-;/m0./s1
InChIKeyMKINDFMDNPVXCE-PPHPATTJSA-N
XLogP3.41
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.89
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride?
The IUPAC name of (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride (CID 50999200) is (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride.
What is the SMILES notation for (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride?
The canonical SMILES for (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride is CC(C)[C@@H](N)CO[Si](C)(C)C(C)(C)C.Cl.
What is the InChIKey of (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride?
The InChIKey is MKINDFMDNPVXCE-PPHPATTJSA-N. The full InChI is InChI=1S/C11H27NOSi.ClH/c1-9(2)10(12)8-13-14(6,7)11(3,4)5;/h9-10H,8,12H2,1-7H3;1H/t10-;/m0./s1.
What are the key properties of (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride?
(2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride has a molecular weight of 253.89 g/mol, XLogP of 3.41, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-2-amine;hydrochloride is sourced from PubChem (CID 50999200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).