3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine

C14H20N2O2 — CID 79920725

IUPAC3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine
SMILESNc1ncccc1CC1CCOC2(CCOC2)C1
InChIInChI=1S/C14H20N2O2/c15-13-12(2-1-5-16-13)8-11-3-6-18-14(9-11)4-7-17-10-14/h1-2,5,11H,3-4,6-10H2,(H2,15,16)
InChIKeyRGXXLPBVVJOTKP-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.79
Rot. Bonds2

About 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine

3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine (PubChem CID 79920725) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine
PubChem CID79920725
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine
SMILESNc1ncccc1CC1CCOC2(CCOC2)C1
InChIInChI=1S/C14H20N2O2/c15-13-12(2-1-5-16-13)8-11-3-6-18-14(9-11)4-7-17-10-14/h1-2,5,11H,3-4,6-10H2,(H2,15,16)
InChIKeyRGXXLPBVVJOTKP-UHFFFAOYSA-N
XLogP1.79
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-ethyl-2-pyridinyl)methyl]-2,6-dioxaspiro[4.5]decan-9-amine
CID 82737815
N-methyl-N-(quinolin-5-ylmethyl)-1,9-dioxaspiro[5.5]undecan-4-amine
CID 70780716
[(3-chloro-2-pyridinyl)-(2,6-dioxaspiro[4.5]decan-9-yl)methyl]hydrazine
CID 103445920
1-(2,6-dioxaspiro[4.5]decan-9-yl)-2-pyridin-2-ylethanol
CID 79921089
3-(2,6-dioxaspiro[4.5]decan-9-yl)-1-phenylpropan-1-ol
CID 79923532
2,6-dioxaspiro[4.5]decan-9-yl 2-(2-aminophenyl)acetate
CID 79908757
1,9-dioxaspiro[5.5]undecan-4-yl-(3-ethyl-2-pyridinyl)methanol
CID 82732432
2-(2-chlorophenyl)-1-(2,6-dioxaspiro[4.5]decan-9-yl)ethanamine
CID 79914830
2-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)-1,2,3,4-tetrahydroquinoline
CID 79910044
3-(6-oxaspiro[4.5]decan-9-yloxy)pyridin-2-amine
CID 79904908
3-[(4-amino-1-fluorocyclohexyl)methyl]pyridin-2-amine
CID 112562418
2-[2-(2,6-dioxaspiro[4.5]decan-9-yloxy)-3-methylphenyl]ethanamine
CID 115957697

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine?
The IUPAC name of 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine (CID 79920725) is 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine?
The canonical SMILES for 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine is Nc1ncccc1CC1CCOC2(CCOC2)C1.
What is the InChIKey of 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine?
The InChIKey is RGXXLPBVVJOTKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c15-13-12(2-1-5-16-13)8-11-3-6-18-14(9-11)4-7-17-10-14/h1-2,5,11H,3-4,6-10H2,(H2,15,16).
What are the key properties of 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine?
3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine has a molecular weight of 248.33 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dioxaspiro[4.5]decan-9-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 79920725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).