5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one

C10H20N2O2 — CID 130571805

IUPAC5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one
SMILESCOC(C)CN1C(=O)CCC(N)C1C
InChIInChI=1S/C10H20N2O2/c1-7(14-3)6-12-8(2)9(11)4-5-10(12)13/h7-9H,4-6,11H2,1-3H3
InChIKeyYADVKWQEOLVTEY-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.36
Rot. Bonds3

About 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one

5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one (PubChem CID 130571805) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one.

Molecular Properties

Compound Name5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one
PubChem CID130571805
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one
SMILESCOC(C)CN1C(=O)CCC(N)C1C
InChIInChI=1S/C10H20N2O2/c1-7(14-3)6-12-8(2)9(11)4-5-10(12)13/h7-9H,4-6,11H2,1-3H3
InChIKeyYADVKWQEOLVTEY-UHFFFAOYSA-N
XLogP0.36
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one?
The IUPAC name of 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one (CID 130571805) is 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one.
What is the SMILES notation for 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one?
The canonical SMILES for 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one is COC(C)CN1C(=O)CCC(N)C1C.
What is the InChIKey of 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one?
The InChIKey is YADVKWQEOLVTEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-7(14-3)6-12-8(2)9(11)4-5-10(12)13/h7-9H,4-6,11H2,1-3H3.
What are the key properties of 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one?
5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one has a molecular weight of 200.28 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one is sourced from PubChem (CID 130571805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).