2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine

C15H26BrNOSi — CID 70200388

IUPAC2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine
SMILESCC(N)(CO[Si](C)(C)C(C)(C)C)c1ccc(Br)cc1
InChIInChI=1S/C15H26BrNOSi/c1-14(2,3)19(5,6)18-11-15(4,17)12-7-9-13(16)10-8-12/h7-10H,11,17H2,1-6H3
InChIKeyMHLHHDPOSGGAHG-UHFFFAOYSA-N
MW344.37 g/mol
LogP4.64
Rot. Bonds4

About 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine

2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine (PubChem CID 70200388) has the molecular formula C15H26BrNOSi and a molecular weight of 344.37 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine
PubChem CID70200388
Molecular FormulaC15H26BrNOSi
Molecular Weight344.37 g/mol
Exact Mass343.10
IUPAC Name2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine
SMILESCC(N)(CO[Si](C)(C)C(C)(C)C)c1ccc(Br)cc1
InChIInChI=1S/C15H26BrNOSi/c1-14(2,3)19(5,6)18-11-15(4,17)12-7-9-13(16)10-8-12/h7-10H,11,17H2,1-6H3
InChIKeyMHLHHDPOSGGAHG-UHFFFAOYSA-N
XLogP4.64
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4-bromophenyl)methoxy-tert-butyl-dimethylsilane
CID 10859583
2-trimethylsilylethyl 2-(4-bromophenyl)-7-[tert-butyl(dimethyl)silyl]oxy-2,6,6-trimethylheptanoate
CID 171078028
bis(4-bromophenyl)-[[tert-butyl(dimethyl)silyl]oxymethyl]-sulfanylidene-λ5-phosphane
CID 132967695
2-(4-bromophenyl)-1-(5-ethylthiophen-2-yl)propan-2-amine
CID 55096063
(2R)-2-(4-bromophenyl)-5,5,5-trifluoro-4,4-dimethylpentan-2-amine
CID 157332352
2-(4-bromophenyl)propan-2-amine;hydroiodide
CID 163210830
[3-(4-bromophenyl)cyclobutyl]methoxy-tert-butyl-dimethylsilane
CID 155744450
tert-butyl-[2-(6-fluoro-3-pyridinyl)-2-methylpropoxy]-dimethylsilane
CID 66600694
2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]propan-2-amine
CID 10801667
tert-butyl-[(4-tert-butylphenyl)methoxy]-dimethylsilane
CID 101140446
2-(4-bromophenyl)-1-(5-bromo-3-pyridinyl)propan-2-amine
CID 104802785
2-(4-bromophenyl)-1-(1-methylpyrazol-3-yl)propan-2-amine
CID 82869106

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine?
The IUPAC name of 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine (CID 70200388) is 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine.
What is the SMILES notation for 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine?
The canonical SMILES for 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine is CC(N)(CO[Si](C)(C)C(C)(C)C)c1ccc(Br)cc1.
What is the InChIKey of 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine?
The InChIKey is MHLHHDPOSGGAHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26BrNOSi/c1-14(2,3)19(5,6)18-11-15(4,17)12-7-9-13(16)10-8-12/h7-10H,11,17H2,1-6H3.
What are the key properties of 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine?
2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine has a molecular weight of 344.37 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-[tert-butyl(dimethyl)silyl]oxypropan-2-amine is sourced from PubChem (CID 70200388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).