(5R)-1-oxa-7-azaspiro[4.4]nonane

C7H13NO — CID 86332598

IUPAC(5R)-1-oxa-7-azaspiro[4.4]nonane
SMILESC1CO[C@]2(C1)CCNC2
InChIInChI=1S/C7H13NO/c1-2-7(9-5-1)3-4-8-6-7/h8H,1-6H2/t7-/m1/s1
InChIKeyTUDSQZVIXYHEHF-SSDOTTSWSA-N
MW127.19 g/mol
LogP0.53
Rot. Bonds

About (5R)-1-oxa-7-azaspiro[4.4]nonane

(5R)-1-oxa-7-azaspiro[4.4]nonane (PubChem CID 86332598) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is (5R)-1-oxa-7-azaspiro[4.4]nonane.

Molecular Properties

Compound Name(5R)-1-oxa-7-azaspiro[4.4]nonane
PubChem CID86332598
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name(5R)-1-oxa-7-azaspiro[4.4]nonane
SMILESC1CO[C@]2(C1)CCNC2
InChIInChI=1S/C7H13NO/c1-2-7(9-5-1)3-4-8-6-7/h8H,1-6H2/t7-/m1/s1
InChIKeyTUDSQZVIXYHEHF-SSDOTTSWSA-N
XLogP0.53
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-1-oxa-7-azaspiro[4.4]nonane?
The IUPAC name of (5R)-1-oxa-7-azaspiro[4.4]nonane (CID 86332598) is (5R)-1-oxa-7-azaspiro[4.4]nonane.
What is the SMILES notation for (5R)-1-oxa-7-azaspiro[4.4]nonane?
The canonical SMILES for (5R)-1-oxa-7-azaspiro[4.4]nonane is C1CO[C@]2(C1)CCNC2.
What is the InChIKey of (5R)-1-oxa-7-azaspiro[4.4]nonane?
The InChIKey is TUDSQZVIXYHEHF-SSDOTTSWSA-N. The full InChI is InChI=1S/C7H13NO/c1-2-7(9-5-1)3-4-8-6-7/h8H,1-6H2/t7-/m1/s1.
What are the key properties of (5R)-1-oxa-7-azaspiro[4.4]nonane?
(5R)-1-oxa-7-azaspiro[4.4]nonane has a molecular weight of 127.19 g/mol, XLogP of 0.53, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-1-oxa-7-azaspiro[4.4]nonane is sourced from PubChem (CID 86332598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).