(4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone

C13H24N2O2 — CID 113280563

IUPAC(4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone
SMILESCC1CCCC(C)N1C(=O)C1(N)CCOCC1
InChIInChI=1S/C13H24N2O2/c1-10-4-3-5-11(2)15(10)12(16)13(14)6-8-17-9-7-13/h10-11H,3-9,14H2,1-2H3
InChIKeyFNCJBTIMQGVCTQ-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.28
Rot. Bonds1

About (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone

(4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone (PubChem CID 113280563) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone
PubChem CID113280563
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone
SMILESCC1CCCC(C)N1C(=O)C1(N)CCOCC1
InChIInChI=1S/C13H24N2O2/c1-10-4-3-5-11(2)15(10)12(16)13(14)6-8-17-9-7-13/h10-11H,3-9,14H2,1-2H3
InChIKeyFNCJBTIMQGVCTQ-UHFFFAOYSA-N
XLogP1.28
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone?
The IUPAC name of (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone (CID 113280563) is (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone?
The canonical SMILES for (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone is CC1CCCC(C)N1C(=O)C1(N)CCOCC1.
What is the InChIKey of (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone?
The InChIKey is FNCJBTIMQGVCTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10-4-3-5-11(2)15(10)12(16)13(14)6-8-17-9-7-13/h10-11H,3-9,14H2,1-2H3.
What are the key properties of (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone?
(4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminooxan-4-yl)-(2,6-dimethylpiperidin-1-yl)methanone is sourced from PubChem (CID 113280563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).