5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one

C13H18N2O2 — CID 43212824

IUPAC5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one
SMILESCCC1CCCCN1C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H18N2O2/c1-2-11-5-3-4-8-15(11)13(17)10-6-7-12(16)14-9-10/h6-7,9,11H,2-5,8H2,1H3,(H,14,16)
InChIKeyQUXPNQHWHHIQFI-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.78
Rot. Bonds2

About 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one

5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one (PubChem CID 43212824) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one
PubChem CID43212824
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one
SMILESCCC1CCCCN1C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C13H18N2O2/c1-2-11-5-3-4-8-15(11)13(17)10-6-7-12(16)14-9-10/h6-7,9,11H,2-5,8H2,1H3,(H,14,16)
InChIKeyQUXPNQHWHHIQFI-UHFFFAOYSA-N
XLogP1.78
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one (CID 43212824) is 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one is CCC1CCCCN1C(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one?
The InChIKey is QUXPNQHWHHIQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-2-11-5-3-4-8-15(11)13(17)10-6-7-12(16)14-9-10/h6-7,9,11H,2-5,8H2,1H3,(H,14,16).
What are the key properties of 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one?
5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one has a molecular weight of 234.30 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylpiperidine-1-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 43212824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).