(1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine

C13H23NOSi — CID 165362171

IUPAC(1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine
SMILESCN[C@@H](C)[C@H](O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C13H23NOSi/c1-11(14-2)13(15-16(3,4)5)12-9-7-6-8-10-12/h6-11,13-14H,1-5H3/t11-,13-/m0/s1
InChIKeySMWXGVMXEZZFOK-AAEUAGOBSA-N
MW237.42 g/mol
LogP3.19
Rot. Bonds5

About (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine

(1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine (PubChem CID 165362171) has the molecular formula C13H23NOSi and a molecular weight of 237.42 g/mol. Its IUPAC name is (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine.

Molecular Properties

Compound Name(1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine
PubChem CID165362171
Molecular FormulaC13H23NOSi
Molecular Weight237.42 g/mol
Exact Mass237.15
IUPAC Name(1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine
SMILESCN[C@@H](C)[C@H](O[Si](C)(C)C)c1ccccc1
InChIInChI=1S/C13H23NOSi/c1-11(14-2)13(15-16(3,4)5)12-9-7-6-8-10-12/h6-11,13-14H,1-5H3/t11-,13-/m0/s1
InChIKeySMWXGVMXEZZFOK-AAEUAGOBSA-N
XLogP3.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.42
LogP ≤ 53.19
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 (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine?
The IUPAC name of (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine (CID 165362171) is (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine.
What is the SMILES notation for (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine?
The canonical SMILES for (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine is CN[C@@H](C)[C@H](O[Si](C)(C)C)c1ccccc1.
What is the InChIKey of (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine?
The InChIKey is SMWXGVMXEZZFOK-AAEUAGOBSA-N. The full InChI is InChI=1S/C13H23NOSi/c1-11(14-2)13(15-16(3,4)5)12-9-7-6-8-10-12/h6-11,13-14H,1-5H3/t11-,13-/m0/s1.
What are the key properties of (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine?
(1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine has a molecular weight of 237.42 g/mol, XLogP of 3.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S)-N-methyl-1-phenyl-1-trimethylsilyloxypropan-2-amine is sourced from PubChem (CID 165362171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).