oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine

C14H25NO2 — CID 79911423

IUPACoxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine
SMILESNC(C1CCCOC1)C1CCOC2(CCC2)C1
InChIInChI=1S/C14H25NO2/c15-13(12-3-1-7-16-10-12)11-4-8-17-14(9-11)5-2-6-14/h11-13H,1-10,15H2
InChIKeyCVWSFEOGUZNBOB-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.09
Rot. Bonds2

About oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine

oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine (PubChem CID 79911423) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine.

Molecular Properties

Compound Nameoxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine
PubChem CID79911423
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Nameoxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine
SMILESNC(C1CCCOC1)C1CCOC2(CCC2)C1
InChIInChI=1S/C14H25NO2/c15-13(12-3-1-7-16-10-12)11-4-8-17-14(9-11)5-2-6-14/h11-13H,1-10,15H2
InChIKeyCVWSFEOGUZNBOB-UHFFFAOYSA-N
XLogP2.09
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

cyclopentyl(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79914728
bis(oxan-3-yl)methanamine
CID 107136437
cyclohexyl(1,9-dioxaspiro[5.5]undecan-4-yl)methanamine
CID 79914524
5-oxaspiro[3.5]nonan-8-yl(oxolan-3-yl)methanol
CID 79913378
(3-methylcyclohexyl)-(6-oxaspiro[4.5]decan-9-yl)methanamine
CID 79914646
6-oxaspiro[4.5]decan-9-yl-(2,2,3,3-tetramethylcyclopropyl)methanamine
CID 105016821
(4,4-dimethylcyclohexyl)-(1-oxaspiro[5.5]undecan-4-yl)methanamine
CID 79910537
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine
CID 105010294
2,2-difluoro-1-(5-oxaspiro[3.5]nonan-8-yl)ethanamine
CID 103516870
cyclooctyl(1-oxa-9-thiaspiro[5.5]undecan-4-yl)methanamine
CID 80610523
1,9-dioxaspiro[5.5]undecan-4-yl-(3-methylcyclohexyl)methanamine
CID 79914941
cyclobutyl(oxolan-3-yl)methanamine
CID 64986324

Frequently Asked Questions

What is the IUPAC name of oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine?
The IUPAC name of oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine (CID 79911423) is oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine.
What is the SMILES notation for oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine?
The canonical SMILES for oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine is NC(C1CCCOC1)C1CCOC2(CCC2)C1.
What is the InChIKey of oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine?
The InChIKey is CVWSFEOGUZNBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c15-13(12-3-1-7-16-10-12)11-4-8-17-14(9-11)5-2-6-14/h11-13H,1-10,15H2.
What are the key properties of oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine?
oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine has a molecular weight of 239.36 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-3-yl(5-oxaspiro[3.5]nonan-8-yl)methanamine is sourced from PubChem (CID 79911423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).