2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine

C17H32N2O — CID 102897697

IUPAC2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine
SMILESCC1CCCC(C)N1NCC1CCC2(CCCCC2)O1
InChIInChI=1S/C17H32N2O/c1-14-7-6-8-15(2)19(14)18-13-16-9-12-17(20-16)10-4-3-5-11-17/h14-16,18H,3-13H2,1-2H3
InChIKeyDGWXZSOQQIOMSF-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.64
Rot. Bonds3

About 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine

2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine (PubChem CID 102897697) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine.

Molecular Properties

Compound Name2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine
PubChem CID102897697
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine
SMILESCC1CCCC(C)N1NCC1CCC2(CCCCC2)O1
InChIInChI=1S/C17H32N2O/c1-14-7-6-8-15(2)19(14)18-13-16-9-12-17(20-16)10-4-3-5-11-17/h14-16,18H,3-13H2,1-2H3
InChIKeyDGWXZSOQQIOMSF-UHFFFAOYSA-N
XLogP3.64
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine?
The IUPAC name of 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine (CID 102897697) is 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine.
What is the SMILES notation for 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine?
The canonical SMILES for 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine is CC1CCCC(C)N1NCC1CCC2(CCCCC2)O1.
What is the InChIKey of 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine?
The InChIKey is DGWXZSOQQIOMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-14-7-6-8-15(2)19(14)18-13-16-9-12-17(20-16)10-4-3-5-11-17/h14-16,18H,3-13H2,1-2H3.
What are the key properties of 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine?
2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine has a molecular weight of 280.46 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(1-oxaspiro[4.5]decan-2-ylmethyl)piperidin-1-amine is sourced from PubChem (CID 102897697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).