4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol

C14H25NO2 — CID 103982956

IUPAC4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol
SMILESOC1(C2CCOC3(CCC3)C2)CCCNCC1
InChIInChI=1S/C14H25NO2/c16-14(6-2-8-15-9-7-14)12-3-10-17-13(11-12)4-1-5-13/h12,15-16H,1-11H2
InChIKeyDHVBKYKNMNTYRR-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.84
Rot. Bonds1

About 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol

4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol (PubChem CID 103982956) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol.

Molecular Properties

Compound Name4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol
PubChem CID103982956
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol
SMILESOC1(C2CCOC3(CCC3)C2)CCCNCC1
InChIInChI=1S/C14H25NO2/c16-14(6-2-8-15-9-7-14)12-3-10-17-13(11-12)4-1-5-13/h12,15-16H,1-11H2
InChIKeyDHVBKYKNMNTYRR-UHFFFAOYSA-N
XLogP1.84
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol with MolForge

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Related Compounds

4-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)azepan-4-ol
CID 103982929
1-(6-oxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912854
4-(6-oxa-2-thiaspiro[4.5]decan-9-yl)azepan-4-ol
CID 103983033
1-(1-oxaspiro[5.5]undecan-4-yl)cyclohexan-1-ol
CID 79900915
4,4-dimethyl-1-(5-oxaspiro[3.5]nonan-8-yl)cycloheptan-1-ol
CID 79913776
3-(2,6-dioxaspiro[4.5]decan-9-yl)piperidin-3-ol
CID 79902057
4-fluoro-4-(5-oxaspiro[3.5]nonan-8-yl)piperidine
CID 112563277
1-(2,6-dioxaspiro[4.5]decan-9-yl)cyclobutan-1-ol
CID 79912746
4-(methylamino)-1-(5-oxaspiro[3.5]nonan-8-yl)cyclohexan-1-ol
CID 79923576
1-methyl-4-(5-oxaspiro[3.5]nonan-8-yl)piperidin-4-ol
CID 79899741
3-(6-oxaspiro[4.5]decan-9-yl)oxan-3-ol
CID 79913860
4-cyclopentylazepan-4-ol
CID 83684103

Frequently Asked Questions

What is the IUPAC name of 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol?
The IUPAC name of 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol (CID 103982956) is 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol.
What is the SMILES notation for 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol?
The canonical SMILES for 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol is OC1(C2CCOC3(CCC3)C2)CCCNCC1.
What is the InChIKey of 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol?
The InChIKey is DHVBKYKNMNTYRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c16-14(6-2-8-15-9-7-14)12-3-10-17-13(11-12)4-1-5-13/h12,15-16H,1-11H2.
What are the key properties of 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol?
4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol has a molecular weight of 239.36 g/mol, XLogP of 1.84, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-oxaspiro[3.5]nonan-8-yl)azepan-4-ol is sourced from PubChem (CID 103982956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).