2-oxa-7-azaspiro[3.4]octan-5-ylmethanol

C7H13NO2 — CID 134828577

IUPAC2-oxa-7-azaspiro[3.4]octan-5-ylmethanol
SMILESOCC1CNCC12COC2
InChIInChI=1S/C7H13NO2/c9-2-6-1-8-3-7(6)4-10-5-7/h6,8-9H,1-5H2
InChIKeyBLCHBMRZGFLZLZ-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.79
Rot. Bonds1

About 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol

2-oxa-7-azaspiro[3.4]octan-5-ylmethanol (PubChem CID 134828577) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol.

Molecular Properties

Compound Name2-oxa-7-azaspiro[3.4]octan-5-ylmethanol
PubChem CID134828577
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name2-oxa-7-azaspiro[3.4]octan-5-ylmethanol
SMILESOCC1CNCC12COC2
InChIInChI=1S/C7H13NO2/c9-2-6-1-8-3-7(6)4-10-5-7/h6,8-9H,1-5H2
InChIKeyBLCHBMRZGFLZLZ-UHFFFAOYSA-N
XLogP-0.79
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol?
The IUPAC name of 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol (CID 134828577) is 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol.
What is the SMILES notation for 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol?
The canonical SMILES for 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol is OCC1CNCC12COC2.
What is the InChIKey of 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol?
The InChIKey is BLCHBMRZGFLZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO2/c9-2-6-1-8-3-7(6)4-10-5-7/h6,8-9H,1-5H2.
What are the key properties of 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol?
2-oxa-7-azaspiro[3.4]octan-5-ylmethanol has a molecular weight of 143.19 g/mol, XLogP of -0.79, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxa-7-azaspiro[3.4]octan-5-ylmethanol is sourced from PubChem (CID 134828577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).