[5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol

C11H16N2O2 — CID 19809494

IUPAC[5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol
SMILESOCc1ncc(C23CCCN(CC2)C3)o1
InChIInChI=1S/C11H16N2O2/c14-7-10-12-6-9(15-10)11-2-1-4-13(8-11)5-3-11/h6,14H,1-5,7-8H2
InChIKeyXJUWQTZKAQHVCP-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.90
Rot. Bonds2

About [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol

[5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol (PubChem CID 19809494) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol.

Molecular Properties

Compound Name[5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol
PubChem CID19809494
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name[5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol
SMILESOCc1ncc(C23CCCN(CC2)C3)o1
InChIInChI=1S/C11H16N2O2/c14-7-10-12-6-9(15-10)11-2-1-4-13(8-11)5-3-11/h6,14H,1-5,7-8H2
InChIKeyXJUWQTZKAQHVCP-UHFFFAOYSA-N
XLogP0.90
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol?
The IUPAC name of [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol (CID 19809494) is [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol.
What is the SMILES notation for [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol?
The canonical SMILES for [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol is OCc1ncc(C23CCCN(CC2)C3)o1.
What is the InChIKey of [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol?
The InChIKey is XJUWQTZKAQHVCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c14-7-10-12-6-9(15-10)11-2-1-4-13(8-11)5-3-11/h6,14H,1-5,7-8H2.
What are the key properties of [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol?
[5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol has a molecular weight of 208.26 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-azabicyclo[3.2.1]octan-5-yl)-1,3-oxazol-2-yl]methanol is sourced from PubChem (CID 19809494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).