5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one

C15H23N3O2 — CID 63156508

IUPAC5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one
SMILESCCC1(C)CCN(C(=O)Cn2cc(N)ccc2=O)CC1
InChIInChI=1S/C15H23N3O2/c1-3-15(2)6-8-17(9-7-15)14(20)11-18-10-12(16)4-5-13(18)19/h4-5,10H,3,6-9,11,16H2,1-2H3
InChIKeyXSBWPDXLHSAFCP-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.47
Rot. Bonds3

About 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one

5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one (PubChem CID 63156508) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one.

Molecular Properties

Compound Name5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one
PubChem CID63156508
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one
SMILESCCC1(C)CCN(C(=O)Cn2cc(N)ccc2=O)CC1
InChIInChI=1S/C15H23N3O2/c1-3-15(2)6-8-17(9-7-15)14(20)11-18-10-12(16)4-5-13(18)19/h4-5,10H,3,6-9,11,16H2,1-2H3
InChIKeyXSBWPDXLHSAFCP-UHFFFAOYSA-N
XLogP1.47
TPSA68.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one?
The IUPAC name of 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one (CID 63156508) is 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one.
What is the SMILES notation for 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one?
The canonical SMILES for 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one is CCC1(C)CCN(C(=O)Cn2cc(N)ccc2=O)CC1.
What is the InChIKey of 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one?
The InChIKey is XSBWPDXLHSAFCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-15(2)6-8-17(9-7-15)14(20)11-18-10-12(16)4-5-13(18)19/h4-5,10H,3,6-9,11,16H2,1-2H3.
What are the key properties of 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one?
5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one has a molecular weight of 277.37 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-[2-(4-ethyl-4-methylpiperidin-1-yl)-2-oxoethyl]pyridin-2-one is sourced from PubChem (CID 63156508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).