(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol

C7H13NO2 — CID 129389910

IUPAC(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol
SMILESO[C@H]1CO[C@]2(CCNC2)C1
InChIInChI=1S/C7H13NO2/c9-6-3-7(10-4-6)1-2-8-5-7/h6,8-9H,1-5H2/t6-,7-/m1/s1
InChIKeyQPMVKECMMBYVGU-RNFRBKRXSA-N
MW143.19 g/mol
LogP-0.50
Rot. Bonds

About (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol

(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol (PubChem CID 129389910) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol.

Molecular Properties

Compound Name(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol
PubChem CID129389910
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol
SMILESO[C@H]1CO[C@]2(CCNC2)C1
InChIInChI=1S/C7H13NO2/c9-6-3-7(10-4-6)1-2-8-5-7/h6,8-9H,1-5H2/t6-,7-/m1/s1
InChIKeyQPMVKECMMBYVGU-RNFRBKRXSA-N
XLogP-0.50
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(5R,9S)-6-oxa-2-azaspiro[4.5]decan-9-ol
CID 129497505
(3S)-1-oxaspiro[4.4]nonan-3-ol
CID 124707938
1-oxa-9-azaspiro[5.5]undecan-4-ol
CID 56760832
(7S)-5-oxa-2-azaspiro[3.4]octan-7-ol;2,2,2-trifluoroacetic acid
CID 146273108
(3R,5R)-3-(cyclopropylmethoxy)-1-oxa-7-azaspiro[4.4]nonane
CID 97486843
3-methyl-1-oxa-9-azaspiro[4.5]decane
CID 167145423
3-hydroxy-1-oxaspiro[4.5]decan-8-one
CID 59200776
6-oxa-2,9-diazaspiro[4.5]decane
CID 23135352
3-fluoro-1-oxa-8-azaspiro[4.5]decane
CID 55280856
(3R,5R)-3-pyridin-3-yloxy-1-oxa-7-azaspiro[4.4]nonane
CID 97486909
(3R,5S)-3-pyridin-2-yloxy-1-oxa-7-azaspiro[4.4]nonane
CID 97420064
(3R,5S)-3-(oxan-4-ylmethoxy)-1-oxa-7-azaspiro[4.4]nonane
CID 97487542

Frequently Asked Questions

What is the IUPAC name of (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol?
The IUPAC name of (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol (CID 129389910) is (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol.
What is the SMILES notation for (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol?
The canonical SMILES for (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol is O[C@H]1CO[C@]2(CCNC2)C1.
What is the InChIKey of (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol?
The InChIKey is QPMVKECMMBYVGU-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H13NO2/c9-6-3-7(10-4-6)1-2-8-5-7/h6,8-9H,1-5H2/t6-,7-/m1/s1.
What are the key properties of (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol?
(3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol has a molecular weight of 143.19 g/mol, XLogP of -0.50, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-1-oxa-7-azaspiro[4.4]nonan-3-ol is sourced from PubChem (CID 129389910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).