3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine

C14H20N2O3 — CID 79905053

IUPAC3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine
SMILESCc1ccc(OC2CCOC3(CCOC3)C2)c(N)n1
InChIInChI=1S/C14H20N2O3/c1-10-2-3-12(13(15)16-10)19-11-4-6-18-14(8-11)5-7-17-9-14/h2-3,11H,4-9H2,1H3,(H2,15,16)
InChIKeyWXAGQZGQAQXVGJ-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.69
Rot. Bonds2

About 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine

3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine (PubChem CID 79905053) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine
PubChem CID79905053
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine
SMILESCc1ccc(OC2CCOC3(CCOC3)C2)c(N)n1
InChIInChI=1S/C14H20N2O3/c1-10-2-3-12(13(15)16-10)19-11-4-6-18-14(8-11)5-7-17-9-14/h2-3,11H,4-9H2,1H3,(H2,15,16)
InChIKeyWXAGQZGQAQXVGJ-UHFFFAOYSA-N
XLogP1.69
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2,6-dioxaspiro[4.5]decan-9-yloxy)-5-methoxyaniline
CID 79904832
9-(2,3-dimethylphenoxy)-2,6-dioxaspiro[4.5]decane
CID 103432370
9-(4-methylphenoxy)-2,6-dioxaspiro[4.5]decane
CID 79922926
4-(2,6-dioxaspiro[4.5]decan-9-yloxy)-5-fluoro-2-methylaniline
CID 114415938
2-[2-(2,6-dioxaspiro[4.5]decan-9-yloxy)-5-methylphenyl]ethanamine
CID 79908450
6-methyl-3-(5-oxaspiro[3.5]nonan-8-yloxy)pyridine-2-carbaldehyde
CID 79905683
(1S)-1-[2-(2,6-dioxaspiro[4.5]decan-9-yloxy)-4-fluorophenyl]ethanamine
CID 79900742
6-methyl-3-(6-oxaspiro[4.5]decan-9-yloxy)pyridine-2-carbaldehyde
CID 79905824
4-(1,9-dioxaspiro[5.5]undecan-4-yloxy)-2,5-dimethylaniline
CID 79898685
3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-4-methylbenzenecarboximidamide
CID 107657216
4-amino-3-(2,6-dioxaspiro[4.5]decan-9-yloxy)benzoic acid
CID 79900845
4-(2,6-dioxaspiro[4.5]decan-9-yloxy)-3-fluorobenzoic acid
CID 107690082

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine?
The IUPAC name of 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine (CID 79905053) is 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine.
What is the SMILES notation for 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine?
The canonical SMILES for 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine is Cc1ccc(OC2CCOC3(CCOC3)C2)c(N)n1.
What is the InChIKey of 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine?
The InChIKey is WXAGQZGQAQXVGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-10-2-3-12(13(15)16-10)19-11-4-6-18-14(8-11)5-7-17-9-14/h2-3,11H,4-9H2,1H3,(H2,15,16).
What are the key properties of 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine?
3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine has a molecular weight of 264.32 g/mol, XLogP of 1.69, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dioxaspiro[4.5]decan-9-yloxy)-6-methylpyridin-2-amine is sourced from PubChem (CID 79905053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).