9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol

C14H27NOSi — CID 171952279

IUPAC9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol
SMILESC=C(C1(O)CC2CCCC(C1)N2C)[Si](C)(C)C
InChIInChI=1S/C14H27NOSi/c1-11(17(3,4)5)14(16)9-12-7-6-8-13(10-14)15(12)2/h12-13,16H,1,6-10H2,2-5H3
InChIKeyKIUOBCFCMUJOOD-UHFFFAOYSA-N
MW253.46 g/mol
LogP2.80
Rot. Bonds2

About 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol

9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol (PubChem CID 171952279) has the molecular formula C14H27NOSi and a molecular weight of 253.46 g/mol. Its IUPAC name is 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol.

Molecular Properties

Compound Name9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol
PubChem CID171952279
Molecular FormulaC14H27NOSi
Molecular Weight253.46 g/mol
Exact Mass253.19
IUPAC Name9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol
SMILESC=C(C1(O)CC2CCCC(C1)N2C)[Si](C)(C)C
InChIInChI=1S/C14H27NOSi/c1-11(17(3,4)5)14(16)9-12-7-6-8-13(10-14)15(12)2/h12-13,16H,1,6-10H2,2-5H3
InChIKeyKIUOBCFCMUJOOD-UHFFFAOYSA-N
XLogP2.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
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 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol?
The IUPAC name of 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol (CID 171952279) is 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol.
What is the SMILES notation for 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol?
The canonical SMILES for 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol is C=C(C1(O)CC2CCCC(C1)N2C)[Si](C)(C)C.
What is the InChIKey of 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol?
The InChIKey is KIUOBCFCMUJOOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NOSi/c1-11(17(3,4)5)14(16)9-12-7-6-8-13(10-14)15(12)2/h12-13,16H,1,6-10H2,2-5H3.
What are the key properties of 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol?
9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol has a molecular weight of 253.46 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-3-(1-trimethylsilylethenyl)-9-azabicyclo[3.3.1]nonan-3-ol is sourced from PubChem (CID 171952279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).