6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine

C7H14N2O — CID 91618386

IUPAC6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine
SMILESNCC1CC2(CNC2)CO1
InChIInChI=1S/C7H14N2O/c8-2-6-1-7(5-10-6)3-9-4-7/h6,9H,1-5,8H2
InChIKeyDMNHJXJFSLPSGL-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.68
Rot. Bonds1

About 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine

6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine (PubChem CID 91618386) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine.

Molecular Properties

Compound Name6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine
PubChem CID91618386
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine
SMILESNCC1CC2(CNC2)CO1
InChIInChI=1S/C7H14N2O/c8-2-6-1-7(5-10-6)3-9-4-7/h6,9H,1-5,8H2
InChIKeyDMNHJXJFSLPSGL-UHFFFAOYSA-N
XLogP-0.68
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine?
The IUPAC name of 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine (CID 91618386) is 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine.
What is the SMILES notation for 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine?
The canonical SMILES for 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine is NCC1CC2(CNC2)CO1.
What is the InChIKey of 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine?
The InChIKey is DMNHJXJFSLPSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c8-2-6-1-7(5-10-6)3-9-4-7/h6,9H,1-5,8H2.
What are the key properties of 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine?
6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine has a molecular weight of 142.20 g/mol, XLogP of -0.68, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxa-2-azaspiro[3.4]octan-7-ylmethanamine is sourced from PubChem (CID 91618386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).