4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol

C16H27NO2 — CID 105365735

IUPAC4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol
SMILESOC1(C2CCOC3(CCCC3)C2)CCN2CCC1C2
InChIInChI=1S/C16H27NO2/c18-16(7-9-17-8-3-14(16)12-17)13-4-10-19-15(11-13)5-1-2-6-15/h13-14,18H,1-12H2
InChIKeyABWVUAJRVDYOEZ-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.18
Rot. Bonds1

About 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol

4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol (PubChem CID 105365735) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol.

Molecular Properties

Compound Name4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol
PubChem CID105365735
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol
SMILESOC1(C2CCOC3(CCCC3)C2)CCN2CCC1C2
InChIInChI=1S/C16H27NO2/c18-16(7-9-17-8-3-14(16)12-17)13-4-10-19-15(11-13)5-1-2-6-15/h13-14,18H,1-12H2
InChIKeyABWVUAJRVDYOEZ-UHFFFAOYSA-N
XLogP2.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol with MolForge

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Related Compounds

1-(1-oxaspiro[5.5]undecan-4-yl)cyclohexan-1-ol
CID 79900915
1-(6-oxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912854
2-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79898835
3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol
CID 79913860
2,4,4-trimethyl-1-(6-oxaspiro[4.5]decan-9-yl)cyclohexan-1-ol
CID 81314576
4-(3,5-dimethylcyclohexyl)-1-azabicyclo[3.2.1]octan-4-ol
CID 105365876
4-(6-oxaspiro[4.5]decan-9-yl)-1-propan-2-ylazepan-4-ol
CID 79907158
1-methyl-4-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-ol
CID 79899741
2,3-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79913866
2-ethyl-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79913769
2-methylsulfonyl-1-(6-oxaspiro[4.5]decan-9-yl)cyclopentan-1-ol
CID 79912938
4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol
CID 103982956

Frequently Asked Questions

What is the IUPAC name of 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol?
The IUPAC name of 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol (CID 105365735) is 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol.
What is the SMILES notation for 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol?
The canonical SMILES for 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol is OC1(C2CCOC3(CCCC3)C2)CCN2CCC1C2.
What is the InChIKey of 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol?
The InChIKey is ABWVUAJRVDYOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c18-16(7-9-17-8-3-14(16)12-17)13-4-10-19-15(11-13)5-1-2-6-15/h13-14,18H,1-12H2.
What are the key properties of 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol?
4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol has a molecular weight of 265.40 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-oxaspiro[4.5]decan-9-yl)-1-azabicyclo[3.2.1]octan-4-ol is sourced from PubChem (CID 105365735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).