3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol

C13H23NO2 — CID 79920128

IUPAC3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol
SMILESCC1(O)CN(C2CCOC3(CCCC3)C2)C1
InChIInChI=1S/C13H23NO2/c1-12(15)9-14(10-12)11-4-7-16-13(8-11)5-2-3-6-13/h11,15H,2-10H2,1H3
InChIKeyCVKUNVFWMGHXBW-UHFFFAOYSA-N
MW225.33 g/mol
LogP1.54
Rot. Bonds1

About 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol

3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol (PubChem CID 79920128) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol.

Molecular Properties

Compound Name3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol
PubChem CID79920128
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol
SMILESCC1(O)CN(C2CCOC3(CCCC3)C2)C1
InChIInChI=1S/C13H23NO2/c1-12(15)9-14(10-12)11-4-7-16-13(8-11)5-2-3-6-13/h11,15H,2-10H2,1H3
InChIKeyCVKUNVFWMGHXBW-UHFFFAOYSA-N
XLogP1.54
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylazetidin-3-ol
CID 79919999
3-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)azetidin-3-ol
CID 79920651
N-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)piperidin-4-amine
CID 79904478
1-[1-(1-oxaspiro[5.5]undecan-4-yl)piperidin-4-yl]ethanone
CID 79906102
N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)piperidin-3-amine
CID 79900304
[6,6-dimethyl-4-(6-oxaspiro[4.5]decan-9-yl)morpholin-2-yl]methanamine
CID 114782506
4-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)piperidine-4-carboximidamide
CID 107161984
methyl (3S)-1-(6-oxaspiro[4.5]decan-9-yl)piperidine-3-carboxylate
CID 115537477
1-(1-oxaspiro[5.5]undecan-4-yl)azetidin-3-amine
CID 79900905
1-(5-oxaspiro[3.5]nonan-8-yl)-1,4-diazepane
CID 79905033
1-(5-oxaspiro[3.5]nonan-8-yl)piperidine-4-carboxylic acid
CID 79894727
N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-3-amine
CID 79900305

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol?
The IUPAC name of 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol (CID 79920128) is 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol.
What is the SMILES notation for 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol?
The canonical SMILES for 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol is CC1(O)CN(C2CCOC3(CCCC3)C2)C1.
What is the InChIKey of 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol?
The InChIKey is CVKUNVFWMGHXBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-12(15)9-14(10-12)11-4-7-16-13(8-11)5-2-3-6-13/h11,15H,2-10H2,1H3.
What are the key properties of 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol?
3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol has a molecular weight of 225.33 g/mol, XLogP of 1.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(6-oxaspiro[4.5]decan-9-yl)azetidin-3-ol is sourced from PubChem (CID 79920128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).