ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide

C11H20N2O4 — CID 158178048

IUPACethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide
SMILESCC.CCC1(C(=O)NO)CC(=O)N(C)C(=O)C1
InChIInChI=1S/C9H14N2O4.C2H6/c1-3-9(8(14)10-15)4-6(12)11(2)7(13)5-9;1-2/h15H,3-5H2,1-2H3,(H,10,14);1-2H3
InChIKeyFYFVSPCCLFRLEB-UHFFFAOYSA-N
MW244.29 g/mol
LogP0.69
Rot. Bonds2

About ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide

ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide (PubChem CID 158178048) has the molecular formula C11H20N2O4 and a molecular weight of 244.29 g/mol. Its IUPAC name is ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide.

Molecular Properties

Compound Nameethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide
PubChem CID158178048
Molecular FormulaC11H20N2O4
Molecular Weight244.29 g/mol
Exact Mass244.14
IUPAC Nameethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide
SMILESCC.CCC1(C(=O)NO)CC(=O)N(C)C(=O)C1
InChIInChI=1S/C9H14N2O4.C2H6/c1-3-9(8(14)10-15)4-6(12)11(2)7(13)5-9;1-2/h15H,3-5H2,1-2H3,(H,10,14);1-2H3
InChIKeyFYFVSPCCLFRLEB-UHFFFAOYSA-N
XLogP0.69
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide?
The IUPAC name of ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide (CID 158178048) is ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide.
What is the SMILES notation for ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide?
The canonical SMILES for ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide is CC.CCC1(C(=O)NO)CC(=O)N(C)C(=O)C1.
What is the InChIKey of ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide?
The InChIKey is FYFVSPCCLFRLEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O4.C2H6/c1-3-9(8(14)10-15)4-6(12)11(2)7(13)5-9;1-2/h15H,3-5H2,1-2H3,(H,10,14);1-2H3.
What are the key properties of ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide?
ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide has a molecular weight of 244.29 g/mol, XLogP of 0.69, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-N-hydroxy-1-methyl-2,6-dioxopiperidine-4-carboxamide is sourced from PubChem (CID 158178048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).