1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine

C13H24N2O2 — CID 115300476

IUPAC1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(C2CCOC3(CCOC3)C2)C1
InChIInChI=1S/C13H24N2O2/c1-14-11-2-5-15(9-11)12-3-6-17-13(8-12)4-7-16-10-13/h11-12,14H,2-10H2,1H3
InChIKeyLZJOWOXDAGYWAZ-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.62
Rot. Bonds2

About 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine

1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine (PubChem CID 115300476) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine
PubChem CID115300476
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine
SMILESCNC1CCN(C2CCOC3(CCOC3)C2)C1
InChIInChI=1S/C13H24N2O2/c1-14-11-2-5-15(9-11)12-3-6-17-13(8-12)4-7-16-10-13/h11-12,14H,2-10H2,1H3
InChIKeyLZJOWOXDAGYWAZ-UHFFFAOYSA-N
XLogP0.62
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)pyrrolidin-3-amine
CID 113281993
(3S)-1-(2,6-dioxaspiro[4.5]decan-9-yl)pyrrolidin-3-amine
CID 115302425
N-methyl-1-(5-oxaspiro[3.5]nonan-8-yl)piperidin-3-amine
CID 79900305
N-methyl-1-(6-oxaspiro[4.5]decan-9-yl)piperidin-3-amine
CID 79900304
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N,4-dimethylpiperidin-4-amine
CID 115304909
[1-(2,6-dioxaspiro[4.5]decan-9-yl)piperidin-4-yl]methanol
CID 79919762
N-methyl-1-(1-oxaspiro[5.5]undecan-4-yl)piperidin-4-amine
CID 79904478
1-(2,6-dioxaspiro[4.5]decan-9-yl)piperidine-4-carbonitrile
CID 79903651
1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-methylazetidin-3-ol
CID 79919999
(3R)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)pyrrolidin-3-ol
CID 79920363
1-(1,9-dioxaspiro[5.5]undecan-4-yl)pyrrolidin-3-amine
CID 79901731
1-(2,6-dioxaspiro[4.5]decan-9-yl)-3-ethylazetidin-3-amine
CID 79919359

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine?
The IUPAC name of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine (CID 115300476) is 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine?
The canonical SMILES for 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine is CNC1CCN(C2CCOC3(CCOC3)C2)C1.
What is the InChIKey of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine?
The InChIKey is LZJOWOXDAGYWAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-14-11-2-5-15(9-11)12-3-6-17-13(8-12)4-7-16-10-13/h11-12,14H,2-10H2,1H3.
What are the key properties of 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine?
1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine has a molecular weight of 240.35 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dioxaspiro[4.5]decan-9-yl)-N-methylpyrrolidin-3-amine is sourced from PubChem (CID 115300476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).