9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane

C10H17NO — CID 155161461

IUPAC9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane
SMILESON1C2CC3CCC(C2)CC1C3
InChIInChI=1S/C10H17NO/c12-11-9-3-7-1-2-8(5-9)6-10(11)4-7/h7-10,12H,1-6H2
InChIKeyYSZQOEXKWSAJRP-UHFFFAOYSA-N
MW167.25 g/mol
LogP2.03
Rot. Bonds

About 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane

9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane (PubChem CID 155161461) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane.

Molecular Properties

Compound Name9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane
PubChem CID155161461
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane
SMILESON1C2CC3CCC(C2)CC1C3
InChIInChI=1S/C10H17NO/c12-11-9-3-7-1-2-8(5-9)6-10(11)4-7/h7-10,12H,1-6H2
InChIKeyYSZQOEXKWSAJRP-UHFFFAOYSA-N
XLogP2.03
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane?
The IUPAC name of 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane (CID 155161461) is 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane.
What is the SMILES notation for 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane?
The canonical SMILES for 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane is ON1C2CC3CCC(C2)CC1C3.
What is the InChIKey of 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane?
The InChIKey is YSZQOEXKWSAJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c12-11-9-3-7-1-2-8(5-9)6-10(11)4-7/h7-10,12H,1-6H2.
What are the key properties of 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane?
9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane has a molecular weight of 167.25 g/mol, XLogP of 2.03, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-9-azatricyclo[4.3.1.13,8]undecane is sourced from PubChem (CID 155161461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).