trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane

C17H25NOSi — CID 14788495

IUPACtrimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane
SMILESC=CC[C@@H]1C[C@H](C[Si](C)(C)C)ON=C1c1ccccc1
InChIInChI=1S/C17H25NOSi/c1-5-9-15-12-16(13-20(2,3)4)19-18-17(15)14-10-7-6-8-11-14/h5-8,10-11,15-16H,1,9,12-13H2,2-4H3/t15-,16-/m1/s1
InChIKeyPCMSEXGXIMHZCY-HZPDHXFCSA-N
MW287.48 g/mol
LogP4.71
Rot. Bonds5

About trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane

trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane (PubChem CID 14788495) has the molecular formula C17H25NOSi and a molecular weight of 287.48 g/mol. Its IUPAC name is trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane.

Molecular Properties

Compound Nametrimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane
PubChem CID14788495
Molecular FormulaC17H25NOSi
Molecular Weight287.48 g/mol
Exact Mass287.17
IUPAC Nametrimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane
SMILESC=CC[C@@H]1C[C@H](C[Si](C)(C)C)ON=C1c1ccccc1
InChIInChI=1S/C17H25NOSi/c1-5-9-15-12-16(13-20(2,3)4)19-18-17(15)14-10-7-6-8-11-14/h5-8,10-11,15-16H,1,9,12-13H2,2-4H3/t15-,16-/m1/s1
InChIKeyPCMSEXGXIMHZCY-HZPDHXFCSA-N
XLogP4.71
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.48
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane with MolForge

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Related Compounds

(5R)-5-benzyl-3-phenyl-4,5-dihydro-1,2-oxazole
CID 71561450
(5S)-5-benzyl-3-phenyl-4,5-dihydro-1,2-oxazole
CID 71561453
5-Benzyl-3-phenyl-4,5-dihydro-1,2-oxazole
CID 13682273
cis-3-Phenyl-4,5-tetramethyleneisoxazoline
CID 12999871
3,5-Dibenzyl-4,5-dihydro-1,2-oxazole
CID 15270458
3-Phenyl-5-(2-phenylethyl)-4,5-dihydro-1,2-oxazole
CID 15445645
3,5-Bis(2-phenylethyl)-4,5-dihydro-1,2-oxazole
CID 24881472
3-Benzyl-5-(2-phenylethyl)-4,5-dihydro-1,2-oxazole
CID 24881813
5-(2-Phenylethyl)-3-(3-phenylpropyl)-4,5-dihydro-1,2-oxazole
CID 15445648
5-Benzyl-3-phenyl-4,5-dihydro-1,2-oxazole;hydrochloride
CID 44585629
3-Phenyl-5-(2-phenylethyl)-4,5-dihydro-1,2-oxazole;hydrochloride
CID 44585630
3-Phenyl-5-methylisoxazoline
CID 12228204

Frequently Asked Questions

What is the IUPAC name of trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane?
The IUPAC name of trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane (CID 14788495) is trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane.
What is the SMILES notation for trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane?
The canonical SMILES for trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane is C=CC[C@@H]1C[C@H](C[Si](C)(C)C)ON=C1c1ccccc1.
What is the InChIKey of trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane?
The InChIKey is PCMSEXGXIMHZCY-HZPDHXFCSA-N. The full InChI is InChI=1S/C17H25NOSi/c1-5-9-15-12-16(13-20(2,3)4)19-18-17(15)14-10-7-6-8-11-14/h5-8,10-11,15-16H,1,9,12-13H2,2-4H3/t15-,16-/m1/s1.
What are the key properties of trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane?
trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane has a molecular weight of 287.48 g/mol, XLogP of 4.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(4R,6R)-3-phenyl-4-prop-2-enyl-5,6-dihydro-4H-oxazin-6-yl]methyl]silane is sourced from PubChem (CID 14788495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).