4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine

C11H20N2O2 — CID 66370479

IUPAC4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine
SMILESNC1COCC1CN1CC2CCC(C1)O2
InChIInChI=1S/C11H20N2O2/c12-11-7-14-6-8(11)3-13-4-9-1-2-10(5-13)15-9/h8-11H,1-7,12H2
InChIKeyZPTKAARIZVGREL-UHFFFAOYSA-N
MW212.29 g/mol
LogP-0.18
Rot. Bonds2

About 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine

4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine (PubChem CID 66370479) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine.

Molecular Properties

Compound Name4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine
PubChem CID66370479
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine
SMILESNC1COCC1CN1CC2CCC(C1)O2
InChIInChI=1S/C11H20N2O2/c12-11-7-14-6-8(11)3-13-4-9-1-2-10(5-13)15-9/h8-11H,1-7,12H2
InChIKeyZPTKAARIZVGREL-UHFFFAOYSA-N
XLogP-0.18
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine?
The IUPAC name of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine (CID 66370479) is 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine.
What is the SMILES notation for 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine?
The canonical SMILES for 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine is NC1COCC1CN1CC2CCC(C1)O2.
What is the InChIKey of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine?
The InChIKey is ZPTKAARIZVGREL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c12-11-7-14-6-8(11)3-13-4-9-1-2-10(5-13)15-9/h8-11H,1-7,12H2.
What are the key properties of 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine?
4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine has a molecular weight of 212.29 g/mol, XLogP of -0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)oxolan-3-amine is sourced from PubChem (CID 66370479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).