2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline

C16H19NOSi — CID 54499747

IUPAC2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline
SMILESCC1CN=C(c2ccc3ccccc3c2)O[Si]1(C)C
InChIInChI=1S/C16H19NOSi/c1-12-11-17-16(18-19(12,2)3)15-9-8-13-6-4-5-7-14(13)10-15/h4-10,12H,11H2,1-3H3
InChIKeyYBPKWVNKLASKTJ-UHFFFAOYSA-N
MW269.42 g/mol
LogP4.21
Rot. Bonds1

About 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline

2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline (PubChem CID 54499747) has the molecular formula C16H19NOSi and a molecular weight of 269.42 g/mol. Its IUPAC name is 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline.

Molecular Properties

Compound Name2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline
PubChem CID54499747
Molecular FormulaC16H19NOSi
Molecular Weight269.42 g/mol
Exact Mass269.12
IUPAC Name2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline
SMILESCC1CN=C(c2ccc3ccccc3c2)O[Si]1(C)C
InChIInChI=1S/C16H19NOSi/c1-12-11-17-16(18-19(12,2)3)15-9-8-13-6-4-5-7-14(13)10-15/h4-10,12H,11H2,1-3H3
InChIKeyYBPKWVNKLASKTJ-UHFFFAOYSA-N
XLogP4.21
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.42
LogP ≤ 54.21
H-Bond Donors ≤ 50
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 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline?
The IUPAC name of 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline (CID 54499747) is 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline.
What is the SMILES notation for 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline?
The canonical SMILES for 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline is CC1CN=C(c2ccc3ccccc3c2)O[Si]1(C)C.
What is the InChIKey of 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline?
The InChIKey is YBPKWVNKLASKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NOSi/c1-12-11-17-16(18-19(12,2)3)15-9-8-13-6-4-5-7-14(13)10-15/h4-10,12H,11H2,1-3H3.
What are the key properties of 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline?
2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline has a molecular weight of 269.42 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3-trimethyl-6-naphthalen-2-yl-3,4-dihydro-1,5,2-oxazasiline is sourced from PubChem (CID 54499747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).