N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine

C11H22N2O2 — CID 106658958

IUPACN-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine
SMILESCC1(C)OCC(NN2CCCCC2)CO1
InChIInChI=1S/C11H22N2O2/c1-11(2)14-8-10(9-15-11)12-13-6-4-3-5-7-13/h10,12H,3-9H2,1-2H3
InChIKeyOBAKKYLDGAHCIV-UHFFFAOYSA-N
MW214.31 g/mol
LogP1.13
Rot. Bonds2

About N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine

N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine (PubChem CID 106658958) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine.

Molecular Properties

Compound NameN-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine
PubChem CID106658958
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine
SMILESCC1(C)OCC(NN2CCCCC2)CO1
InChIInChI=1S/C11H22N2O2/c1-11(2)14-8-10(9-15-11)12-13-6-4-3-5-7-13/h10,12H,3-9H2,1-2H3
InChIKeyOBAKKYLDGAHCIV-UHFFFAOYSA-N
XLogP1.13
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine?
The IUPAC name of N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine (CID 106658958) is N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine.
What is the SMILES notation for N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine?
The canonical SMILES for N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine is CC1(C)OCC(NN2CCCCC2)CO1.
What is the InChIKey of N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine?
The InChIKey is OBAKKYLDGAHCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-11(2)14-8-10(9-15-11)12-13-6-4-3-5-7-13/h10,12H,3-9H2,1-2H3.
What are the key properties of N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine?
N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine has a molecular weight of 214.31 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-1,3-dioxan-5-yl)piperidin-1-amine is sourced from PubChem (CID 106658958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).