1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one

C14H23N3O — CID 82907183

IUPAC1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one
SMILESCCC1CN(CCn2ccccc2=O)CCC1N
InChIInChI=1S/C14H23N3O/c1-2-12-11-16(8-6-13(12)15)9-10-17-7-4-3-5-14(17)18/h3-5,7,12-13H,2,6,8-11,15H2,1H3
InChIKeyLVFUGZXDVKSKGL-UHFFFAOYSA-N
MW249.36 g/mol
LogP0.91
Rot. Bonds4

About 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one

1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one (PubChem CID 82907183) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one
PubChem CID82907183
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one
SMILESCCC1CN(CCn2ccccc2=O)CCC1N
InChIInChI=1S/C14H23N3O/c1-2-12-11-16(8-6-13(12)15)9-10-17-7-4-3-5-14(17)18/h3-5,7,12-13H,2,6,8-11,15H2,1H3
InChIKeyLVFUGZXDVKSKGL-UHFFFAOYSA-N
XLogP0.91
TPSA51.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one?
The IUPAC name of 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one (CID 82907183) is 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one is CCC1CN(CCn2ccccc2=O)CCC1N.
What is the InChIKey of 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one?
The InChIKey is LVFUGZXDVKSKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-2-12-11-16(8-6-13(12)15)9-10-17-7-4-3-5-14(17)18/h3-5,7,12-13H,2,6,8-11,15H2,1H3.
What are the key properties of 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one?
1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one has a molecular weight of 249.36 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-amino-3-ethylpiperidin-1-yl)ethyl]pyridin-2-one is sourced from PubChem (CID 82907183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).