3-ethyl-4-oxopiperidine-1-carboxamide

C8H14N2O2 — CID 114508445

IUPAC3-ethyl-4-oxopiperidine-1-carboxamide
SMILESCCC1CN(C(N)=O)CCC1=O
InChIInChI=1S/C8H14N2O2/c1-2-6-5-10(8(9)12)4-3-7(6)11/h6H,2-5H2,1H3,(H2,9,12)
InChIKeyNCNDGUBGNUNNTJ-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.37
Rot. Bonds1

About 3-ethyl-4-oxopiperidine-1-carboxamide

3-ethyl-4-oxopiperidine-1-carboxamide (PubChem CID 114508445) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 3-ethyl-4-oxopiperidine-1-carboxamide.

Molecular Properties

Compound Name3-ethyl-4-oxopiperidine-1-carboxamide
PubChem CID114508445
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name3-ethyl-4-oxopiperidine-1-carboxamide
SMILESCCC1CN(C(N)=O)CCC1=O
InChIInChI=1S/C8H14N2O2/c1-2-6-5-10(8(9)12)4-3-7(6)11/h6H,2-5H2,1H3,(H2,9,12)
InChIKeyNCNDGUBGNUNNTJ-UHFFFAOYSA-N
XLogP0.37
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,3-diethyl-4-oxopiperidine-1-carboxamide
CID 114508449
3-ethyl-1-(2-methylpentanoyl)piperidin-4-one
CID 114508100
3-ethyl-1-octanoylpiperidin-4-one
CID 114508255
1-benzoyl-3-ethylpiperidin-4-one
CID 114508143
3-ethyl-1-(4-ethylthiadiazole-5-carbonyl)piperidin-4-one
CID 114508168
3-ethyl-1-(2-phenylacetyl)piperidin-4-one
CID 114508365
1-(4-tert-butylcyclohexanecarbonyl)-3-ethylpiperidin-4-one
CID 114508264
6-(3-ethyl-4-oxopiperidine-1-carbonyl)-1H-pyridin-2-one
CID 114040137
1-(1,5-dimethylpyrazole-3-carbonyl)-3-ethylpiperidin-4-one
CID 114218977
1-(3-chlorobenzoyl)-3-ethylpiperidin-4-one
CID 114508192
3-(3-ethyl-4-oxopiperidin-1-yl)propanoic acid
CID 114509620
3-ethyl-1-[2-(trifluoromethyl)benzoyl]piperidin-4-one
CID 114508244

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-oxopiperidine-1-carboxamide?
The IUPAC name of 3-ethyl-4-oxopiperidine-1-carboxamide (CID 114508445) is 3-ethyl-4-oxopiperidine-1-carboxamide.
What is the SMILES notation for 3-ethyl-4-oxopiperidine-1-carboxamide?
The canonical SMILES for 3-ethyl-4-oxopiperidine-1-carboxamide is CCC1CN(C(N)=O)CCC1=O.
What is the InChIKey of 3-ethyl-4-oxopiperidine-1-carboxamide?
The InChIKey is NCNDGUBGNUNNTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-2-6-5-10(8(9)12)4-3-7(6)11/h6H,2-5H2,1H3,(H2,9,12).
What are the key properties of 3-ethyl-4-oxopiperidine-1-carboxamide?
3-ethyl-4-oxopiperidine-1-carboxamide has a molecular weight of 170.21 g/mol, XLogP of 0.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-oxopiperidine-1-carboxamide is sourced from PubChem (CID 114508445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).