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

C16H31NOSi2 — CID 102239963

IUPAC(1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine
SMILESC[C@@H]([C@@H](O[Si](C)(C)C)c1ccccc1)N(C)[Si](C)(C)C
InChIInChI=1S/C16H31NOSi2/c1-14(17(2)19(3,4)5)16(18-20(6,7)8)15-12-10-9-11-13-15/h9-14,16H,1-8H3/t14-,16+/m0/s1
InChIKeyNSADBSUKOIYJDH-GOEBONIOSA-N
MW309.60 g/mol
LogP4.73
Rot. Bonds6

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

(1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine (PubChem CID 102239963) has the molecular formula C16H31NOSi2 and a molecular weight of 309.60 g/mol. Its IUPAC name is (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine.

Molecular Properties

Compound Name(1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine
PubChem CID102239963
Molecular FormulaC16H31NOSi2
Molecular Weight309.60 g/mol
Exact Mass309.19
IUPAC Name(1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine
SMILESC[C@@H]([C@@H](O[Si](C)(C)C)c1ccccc1)N(C)[Si](C)(C)C
InChIInChI=1S/C16H31NOSi2/c1-14(17(2)19(3,4)5)16(18-20(6,7)8)15-12-10-9-11-13-15/h9-14,16H,1-8H3/t14-,16+/m0/s1
InChIKeyNSADBSUKOIYJDH-GOEBONIOSA-N
XLogP4.73
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.60
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-phenyl-N-[(1R,2R)-1-phenyl-1-trimethylsilyloxypropan-2-yl]butanamide
CID 91753971
trimethyl(1-phenylethoxy)silane
CID 519015
N-ethyl-2,2,2-trifluoro-N-(1-phenyl-1-trimethylsilyloxypropan-2-yl)acetamide
CID 91753864
methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
CID 102172480
(E)-N-[(1S,2S)-1-[tert-butyl(dimethyl)silyl]oxy-1-phenylpropan-2-yl]-N-methylhex-2-enamide
CID 24769790
(1R,2S)-2-methyl-3-phenyl-1-[2-(trifluoromethyl)phenyl]-3-trimethylsilyloxypropan-1-ol
CID 72713135
[(1R)-2,2-dimethyl-1-phenylpropoxy]-trimethylsilane
CID 101471174
triphenyl-[2-[phenyl(trimethylsilyloxy)methyl]butyl]phosphanium iodide
CID 18942081
2-phenyl-N-[(1S,2R)-1-phenyl-1-trimethylsilyloxypropan-2-yl]butanamide
CID 91753974
trimethyl-[1-phenoxy-3-(3-phenoxy-3-phenyl-2-trimethylsilyloxypropoxy)-1-phenylpropan-2-yl]oxysilane
CID 139719240
(1S,2R)-1-[tert-butyl(dimethyl)silyl]oxy-N-methyl-1-phenylpropan-2-amine
CID 122223185
tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxy-1,2-bis(4-phenylphenyl)ethoxy]-dimethylsilane
CID 11467474

Frequently Asked Questions

What is the IUPAC name of (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine?
The IUPAC name of (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine (CID 102239963) is (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine.
What is the SMILES notation for (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine?
The canonical SMILES for (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine is C[C@@H]([C@@H](O[Si](C)(C)C)c1ccccc1)N(C)[Si](C)(C)C.
What is the InChIKey of (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine?
The InChIKey is NSADBSUKOIYJDH-GOEBONIOSA-N. The full InChI is InChI=1S/C16H31NOSi2/c1-14(17(2)19(3,4)5)16(18-20(6,7)8)15-12-10-9-11-13-15/h9-14,16H,1-8H3/t14-,16+/m0/s1.
What are the key properties of (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine?
(1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine has a molecular weight of 309.60 g/mol, XLogP of 4.73, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine is sourced from PubChem (CID 102239963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).