3-cyclopentyloxy-8-azabicyclo[3.2.1]octane

C12H21NO — CID 123767329

IUPAC3-cyclopentyloxy-8-azabicyclo[3.2.1]octane
SMILESC1CCC(OC2CC3CCC(C2)N3)C1
InChIInChI=1S/C12H21NO/c1-2-4-11(3-1)14-12-7-9-5-6-10(8-12)13-9/h9-13H,1-8H2
InChIKeyFQVURXUYWXQSAA-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.23
Rot. Bonds2

About 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane

3-cyclopentyloxy-8-azabicyclo[3.2.1]octane (PubChem CID 123767329) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane.

Molecular Properties

Compound Name3-cyclopentyloxy-8-azabicyclo[3.2.1]octane
PubChem CID123767329
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name3-cyclopentyloxy-8-azabicyclo[3.2.1]octane
SMILESC1CCC(OC2CC3CCC(C2)N3)C1
InChIInChI=1S/C12H21NO/c1-2-4-11(3-1)14-12-7-9-5-6-10(8-12)13-9/h9-13H,1-8H2
InChIKeyFQVURXUYWXQSAA-UHFFFAOYSA-N
XLogP2.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane?
The IUPAC name of 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane (CID 123767329) is 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane.
What is the SMILES notation for 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane?
The canonical SMILES for 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane is C1CCC(OC2CC3CCC(C2)N3)C1.
What is the InChIKey of 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane?
The InChIKey is FQVURXUYWXQSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c1-2-4-11(3-1)14-12-7-9-5-6-10(8-12)13-9/h9-13H,1-8H2.
What are the key properties of 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane?
3-cyclopentyloxy-8-azabicyclo[3.2.1]octane has a molecular weight of 195.31 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyloxy-8-azabicyclo[3.2.1]octane is sourced from PubChem (CID 123767329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).