(2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine

C16H27NOSi — CID 15060581

IUPAC(2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine
SMILESC[C@H](/C=N/Cc1ccccc1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H27NOSi/c1-14(18-19(5,6)16(2,3)4)12-17-13-15-10-8-7-9-11-15/h7-12,14H,13H2,1-6H3/b17-12+/t14-/m1/s1
InChIKeyRAIKUTUYMLJPTL-RFRKOGIWSA-N
MW277.48 g/mol
LogP4.67
Rot. Bonds5

About (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine

(2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine (PubChem CID 15060581) has the molecular formula C16H27NOSi and a molecular weight of 277.48 g/mol. Its IUPAC name is (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine.

Molecular Properties

Compound Name(2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine
PubChem CID15060581
Molecular FormulaC16H27NOSi
Molecular Weight277.48 g/mol
Exact Mass277.19
IUPAC Name(2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine
SMILESC[C@H](/C=N/Cc1ccccc1)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H27NOSi/c1-14(18-19(5,6)16(2,3)4)12-17-13-15-10-8-7-9-11-15/h7-12,14H,13H2,1-6H3/b17-12+/t14-/m1/s1
InChIKeyRAIKUTUYMLJPTL-RFRKOGIWSA-N
XLogP4.67
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.48
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-dimethyl-[(2R)-1-phenylpropan-2-yl]oxysilane
CID 59920354
tert-butyl-dimethyl-[(2S,3R)-3-phenylmethoxypent-4-en-2-yl]oxysilane
CID 73333549
(2S)-N-benzyl-2-chloropropan-1-imine
CID 131243971
tert-butyl-dimethyl-[(2S,3S)-3-phenylmethoxypent-4-en-2-yl]oxysilane
CID 73333550
tert-butyl-dimethyl-[(2S)-3-methylidene-5-phenylpentan-2-yl]oxysilane
CID 101349147
(E,2S)-2-[tert-butyl(dimethyl)silyl]oxy-N-trimethylsilylpropan-1-imine
CID 11747325
(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-5-phenylpentanal
CID 53259150
tert-butyl-dimethyl-[(3S,4S)-4-phenylmethoxypent-1-en-3-yl]oxysilane
CID 138976638
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-1-phenylbutan-2-one
CID 101209372
(E,2S,5R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxynon-3-en-5-amine
CID 11371881
(E,2R)-N-benzyl-2-[tert-butyl(diphenyl)silyl]oxynon-3-en-1-imine
CID 134870970
(E,1R,5S)-5-[tert-butyl(dimethyl)silyl]oxy-1-phenylhex-3-en-1-ol
CID 66573505

Frequently Asked Questions

What is the IUPAC name of (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine?
The IUPAC name of (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine (CID 15060581) is (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine.
What is the SMILES notation for (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine?
The canonical SMILES for (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine is C[C@H](/C=N/Cc1ccccc1)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine?
The InChIKey is RAIKUTUYMLJPTL-RFRKOGIWSA-N. The full InChI is InChI=1S/C16H27NOSi/c1-14(18-19(5,6)16(2,3)4)12-17-13-15-10-8-7-9-11-15/h7-12,14H,13H2,1-6H3/b17-12+/t14-/m1/s1.
What are the key properties of (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine?
(2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine has a molecular weight of 277.48 g/mol, XLogP of 4.67, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-benzyl-2-[tert-butyl(dimethyl)silyl]oxypropan-1-imine is sourced from PubChem (CID 15060581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).