N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine

C13H23NOSi — CID 167723210

IUPACN-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine
SMILESCCCNCc1ccccc1O[Si](C)(C)C
InChIInChI=1S/C13H23NOSi/c1-5-10-14-11-12-8-6-7-9-13(12)15-16(2,3)4/h6-9,14H,5,10-11H2,1-4H3
InChIKeyXBBWIWBSFOFBDB-UHFFFAOYSA-N
MW237.42 g/mol
LogP3.40
Rot. Bonds6

About N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine

N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine (PubChem CID 167723210) has the molecular formula C13H23NOSi and a molecular weight of 237.42 g/mol. Its IUPAC name is N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine
PubChem CID167723210
Molecular FormulaC13H23NOSi
Molecular Weight237.42 g/mol
Exact Mass237.15
IUPAC NameN-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine
SMILESCCCNCc1ccccc1O[Si](C)(C)C
InChIInChI=1S/C13H23NOSi/c1-5-10-14-11-12-8-6-7-9-13(12)15-16(2,3)4/h6-9,14H,5,10-11H2,1-4H3
InChIKeyXBBWIWBSFOFBDB-UHFFFAOYSA-N
XLogP3.40
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.42
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]phenyl]methyl]propan-1-amine
CID 60881221
N-[[2-(2,6-dimethylphenoxy)phenyl]methyl]propan-1-amine
CID 43282629
2-[2-[2-(propylaminomethyl)phenoxy]phenyl]ethanol
CID 107712993
N-[[2-(3-ethoxypropoxy)phenyl]methyl]propan-1-amine
CID 65176507
1-[2-(propylaminomethyl)phenoxy]propan-2-ol
CID 60881781
N-[[2-[(2-methyltetrazol-5-yl)methoxy]phenyl]methyl]propan-1-amine
CID 107041124
N-[[2-[(6-methoxy-2-pyridinyl)methoxy]phenyl]methyl]propan-1-amine
CID 63992362
N-[[2-[(2-ethylphenoxy)methyl]phenyl]methyl]propan-1-amine
CID 63496111
N-[[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]phenyl]methyl]propan-1-amine
CID 62455849
N-[[2-[(4-fluorophenyl)methoxy]phenyl]methyl]propan-1-amine
CID 4716600
N-[[2-[2-(2-methoxyethoxy)ethoxy]phenyl]methyl]propan-1-amine
CID 62457882
N-[(2,3-dimethoxyphenyl)methyl]propan-1-amine
CID 4717511

Frequently Asked Questions

What is the IUPAC name of N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine?
The IUPAC name of N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine (CID 167723210) is N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine.
What is the SMILES notation for N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine?
The canonical SMILES for N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine is CCCNCc1ccccc1O[Si](C)(C)C.
What is the InChIKey of N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine?
The InChIKey is XBBWIWBSFOFBDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NOSi/c1-5-10-14-11-12-8-6-7-9-13(12)15-16(2,3)4/h6-9,14H,5,10-11H2,1-4H3.
What are the key properties of N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine?
N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine has a molecular weight of 237.42 g/mol, XLogP of 3.40, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-trimethylsilyloxyphenyl)methyl]propan-1-amine is sourced from PubChem (CID 167723210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).