2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol

C13H23NO3 — CID 106103086

IUPAC2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol
SMILESCC1OCCC1(O)CN1CC2(CCOCC2)C1
InChIInChI=1S/C13H23NO3/c1-11-13(15,4-7-17-11)10-14-8-12(9-14)2-5-16-6-3-12/h11,15H,2-10H2,1H3
InChIKeyTYSLMCYWVZFKDV-UHFFFAOYSA-N
MW241.33 g/mol
LogP0.64
Rot. Bonds2

About 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol

2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol (PubChem CID 106103086) has the molecular formula C13H23NO3 and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol.

Molecular Properties

Compound Name2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol
PubChem CID106103086
Molecular FormulaC13H23NO3
Molecular Weight241.33 g/mol
Exact Mass241.17
IUPAC Name2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol
SMILESCC1OCCC1(O)CN1CC2(CCOCC2)C1
InChIInChI=1S/C13H23NO3/c1-11-13(15,4-7-17-11)10-14-8-12(9-14)2-5-16-6-3-12/h11,15H,2-10H2,1H3
InChIKeyTYSLMCYWVZFKDV-UHFFFAOYSA-N
XLogP0.64
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-1-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)cyclohexan-1-ol
CID 113425808
1-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-2,6-dimethylpyridin-4-one
CID 106103103
N-[(3-hydroxy-2-methyloxolan-3-yl)methyl]morpholine-4-sulfonamide
CID 107271464
4-[(3-hydroxy-2-methyloxolan-3-yl)methyl]thiomorpholine-3,5-dione
CID 106103089
3-(methoxymethyl)-2-methyloxolan-3-ol
CID 82719325
3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]-3-azabicyclo[3.2.1]octane-2,4-dione
CID 114143758
3-[(3-hydroxy-2-methyloxolan-3-yl)methyl]imidazolidine-2,4-dione
CID 106103142
2-methyl-3-[(oxan-4-ylmethylamino)methyl]oxolan-3-ol
CID 107268217
4-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)cyclohexan-1-ol
CID 106131726
2-methyl-3-pentyloxolan-3-ol
CID 82718337
3-hydroxy-2-methyl-3-[(sulfamoylamino)methyl]oxolane
CID 107268641
3-heptyl-2-methyloxolan-3-ol
CID 82718796

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol?
The IUPAC name of 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol (CID 106103086) is 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol.
What is the SMILES notation for 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol?
The canonical SMILES for 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol is CC1OCCC1(O)CN1CC2(CCOCC2)C1.
What is the InChIKey of 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol?
The InChIKey is TYSLMCYWVZFKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO3/c1-11-13(15,4-7-17-11)10-14-8-12(9-14)2-5-16-6-3-12/h11,15H,2-10H2,1H3.
What are the key properties of 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol?
2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol has a molecular weight of 241.33 g/mol, XLogP of 0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(7-oxa-2-azaspiro[3.5]nonan-2-ylmethyl)oxolan-3-ol is sourced from PubChem (CID 106103086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).