1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine

C11H18BrNOSi — CID 167716923

IUPAC1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine
SMILESCNCc1cc(Br)cc(O[Si](C)(C)C)c1
InChIInChI=1S/C11H18BrNOSi/c1-13-8-9-5-10(12)7-11(6-9)14-15(2,3)4/h5-7,13H,8H2,1-4H3
InChIKeyYGUHWVXHKUNKSB-UHFFFAOYSA-N
MW288.26 g/mol
LogP3.38
Rot. Bonds4

About 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine

1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine (PubChem CID 167716923) has the molecular formula C11H18BrNOSi and a molecular weight of 288.26 g/mol. Its IUPAC name is 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine
PubChem CID167716923
Molecular FormulaC11H18BrNOSi
Molecular Weight288.26 g/mol
Exact Mass287.03
IUPAC Name1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine
SMILESCNCc1cc(Br)cc(O[Si](C)(C)C)c1
InChIInChI=1S/C11H18BrNOSi/c1-13-8-9-5-10(12)7-11(6-9)14-15(2,3)4/h5-7,13H,8H2,1-4H3
InChIKeyYGUHWVXHKUNKSB-UHFFFAOYSA-N
XLogP3.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.26
LogP ≤ 53.38
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

1-[4-bromo-6-(methylaminomethyl)-2-pyridinyl]-N-methylmethanamine
CID 70648411
1-[3-[(5-bromo-3-pyridinyl)methoxy]phenyl]-N-methylmethanamine
CID 113454072
1-[4-[(3-bromophenyl)methoxy]phenyl]-N-methylmethanamine
CID 60880082
1-[6-(3-bromophenoxy)-3-pyridinyl]-N-methylmethanamine
CID 55058512
1-[2-(4-bromo-3,5-dimethylphenoxy)-6-methyl-4-pyridinyl]-N-methylmethanamine
CID 107725916
1-[4-(3-bromo-5-fluorophenoxy)-3-chlorophenyl]-N-methylmethanamine
CID 81331494
1-[3,5-dibromo-4-(methoxymethoxy)phenyl]-N-methylmethanamine
CID 107741642
[3-bromo-5-(4-methylpentoxy)phenyl]methanamine
CID 102814559
1-[4-(2,4-dibromophenoxy)phenyl]-N-methylmethanamine
CID 64720895
1-[3,5-dibromo-4-[(5-chlorothiophen-2-yl)methoxy]phenyl]-N-methylmethanamine
CID 107741708
1-[4-[(4-bromothiophen-2-yl)methoxy]-3,5-difluorophenyl]-N-methylmethanamine
CID 79891772
1-[4-[(3-bromophenyl)methoxy]-3,5-difluorophenyl]-N-methylmethanamine
CID 79891483

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine?
The IUPAC name of 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine (CID 167716923) is 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine is CNCc1cc(Br)cc(O[Si](C)(C)C)c1.
What is the InChIKey of 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine?
The InChIKey is YGUHWVXHKUNKSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18BrNOSi/c1-13-8-9-5-10(12)7-11(6-9)14-15(2,3)4/h5-7,13H,8H2,1-4H3.
What are the key properties of 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine?
1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine has a molecular weight of 288.26 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-5-trimethylsilyloxyphenyl)-N-methylmethanamine is sourced from PubChem (CID 167716923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).