(3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one

C18H31NOSi2 — CID 14239378

IUPAC(3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one
SMILESCC(C)(C)[Si](C)(C)N1C(=O)[C@H]([Si](C)(C)C)[C@H]1c1ccccc1
InChIInChI=1S/C18H31NOSi2/c1-18(2,3)22(7,8)19-15(14-12-10-9-11-13-14)16(17(19)20)21(4,5)6/h9-13,15-16H,1-8H3/t15-,16-/m1/s1
InChIKeyAAWJLZAZLKMLIU-HZPDHXFCSA-N
MW333.62 g/mol
LogP5.28
Rot. Bonds3

About (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one

(3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one (PubChem CID 14239378) has the molecular formula C18H31NOSi2 and a molecular weight of 333.62 g/mol. Its IUPAC name is (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one.

Molecular Properties

Compound Name(3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one
PubChem CID14239378
Molecular FormulaC18H31NOSi2
Molecular Weight333.62 g/mol
Exact Mass333.19
IUPAC Name(3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one
SMILESCC(C)(C)[Si](C)(C)N1C(=O)[C@H]([Si](C)(C)C)[C@H]1c1ccccc1
InChIInChI=1S/C18H31NOSi2/c1-18(2,3)22(7,8)19-15(14-12-10-9-11-13-14)16(17(19)20)21(4,5)6/h9-13,15-16H,1-8H3/t15-,16-/m1/s1
InChIKeyAAWJLZAZLKMLIU-HZPDHXFCSA-N
XLogP5.28
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.62
LogP ≤ 55.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-Phenylazetidin-2-one
CID 568818
N-benzyl-N-isopropyl-3-phenylpropanamide
CID 875288
2,2-Dimethyl-1-(2-phenylazetidin-1-yl)propan-1-one
CID 132016672
2-Methyl-1-phenyl-2-azaspiro[3.5]nonan-3-one
CID 44825476
(4Z)-9-benzyl-9-azabicyclo[6.2.0]dec-4-en-10-one
CID 44389694
9-Benzyl-9-azabicyclo[6.2.0]decan-10-one
CID 44389724
(9Z,12Z)-N-benzyl-N-methyloctadeca-9,12-dienamide
CID 70617268
(4S)-1-(2,2-dimethylbut-3-enoyl)-4-phenylazetidin-2-one
CID 121437454
2,2-Dimethyl-1-(2-phenylazetidin-1-yl)butan-1-one
CID 121446466
(4S)-1-(2,2-dimethylbutanoyl)-4-phenylazetidin-2-one
CID 121446472
1-Benzyl-4-methylazetidin-2-one
CID 562612
1-Methyl-4-phenylazetidin-2-one
CID 12695619

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one?
The IUPAC name of (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one (CID 14239378) is (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one.
What is the SMILES notation for (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one?
The canonical SMILES for (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one is CC(C)(C)[Si](C)(C)N1C(=O)[C@H]([Si](C)(C)C)[C@H]1c1ccccc1.
What is the InChIKey of (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one?
The InChIKey is AAWJLZAZLKMLIU-HZPDHXFCSA-N. The full InChI is InChI=1S/C18H31NOSi2/c1-18(2,3)22(7,8)19-15(14-12-10-9-11-13-14)16(17(19)20)21(4,5)6/h9-13,15-16H,1-8H3/t15-,16-/m1/s1.
What are the key properties of (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one?
(3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one has a molecular weight of 333.62 g/mol, XLogP of 5.28, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-1-[tert-butyl(dimethyl)silyl]-4-phenyl-3-trimethylsilylazetidin-2-one is sourced from PubChem (CID 14239378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).