2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane

C16H20N2O4 — CID 144714237

IUPAC2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
SMILESCC.CC(=O)c1ccccc1C(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C14H14N2O4.C2H6/c1-8(17)9-4-2-3-5-10(9)13(19)15-11-6-7-12(18)16-14(11)20;1-2/h2-5,11H,6-7H2,1H3,(H,15,19)(H,16,18,20);1-2H3
InChIKeyHCCHAGOGTBAOPN-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.45
Rot. Bonds3

About 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane

2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane (PubChem CID 144714237) has the molecular formula C16H20N2O4 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane.

Molecular Properties

Compound Name2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
PubChem CID144714237
Molecular FormulaC16H20N2O4
Molecular Weight304.35 g/mol
Exact Mass304.14
IUPAC Name2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
SMILESCC.CC(=O)c1ccccc1C(=O)NC1CCC(=O)NC1=O
InChIInChI=1S/C14H14N2O4.C2H6/c1-8(17)9-4-2-3-5-10(9)13(19)15-11-6-7-12(18)16-14(11)20;1-2/h2-5,11H,6-7H2,1H3,(H,15,19)(H,16,18,20);1-2H3
InChIKeyHCCHAGOGTBAOPN-UHFFFAOYSA-N
XLogP1.45
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-[(3S)-2,6-dioxopiperidin-3-yl]-2-hydroxybenzamide
CID 141087093
N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
CID 156866709
N-[(3S)-2,6-dioxopiperidin-3-yl]-2-methoxybenzamide
CID 175838749
N-[(3R)-2,6-dioxopiperidin-3-yl]-2-methoxybenzamide
CID 165380137
2-(dimethylamino)-N-(2,6-dioxopiperidin-3-yl)pyridine-3-carboxamide
CID 110475174
2-chloro-N-(2,6-dioxopiperidin-3-yl)furan-3-carboxamide
CID 106686964
N-[(3R)-2,6-dioxopiperidin-3-yl]pyridine-2-carboxamide
CID 175992021
N-(2,6-dioxopiperidin-3-yl)-1H-benzimidazole-4-carboxamide
CID 153384900
N-(2,6-dioxopiperidin-3-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103822655
N-(2,6-dioxopiperidin-3-yl)-2-fluoro-4-propan-2-ylbenzamide;ethane
CID 170749929
N-[(3S)-2,6-dioxopiperidin-3-yl]pyrimidine-2-carboxamide
CID 156797860
N-(2,6-dioxopiperidin-3-yl)-3-phenylbenzamide
CID 138467355

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane?
The IUPAC name of 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane (CID 144714237) is 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane.
What is the SMILES notation for 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane?
The canonical SMILES for 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane is CC.CC(=O)c1ccccc1C(=O)NC1CCC(=O)NC1=O.
What is the InChIKey of 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane?
The InChIKey is HCCHAGOGTBAOPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O4.C2H6/c1-8(17)9-4-2-3-5-10(9)13(19)15-11-6-7-12(18)16-14(11)20;1-2/h2-5,11H,6-7H2,1H3,(H,15,19)(H,16,18,20);1-2H3.
What are the key properties of 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane?
2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane has a molecular weight of 304.35 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-(2,6-dioxopiperidin-3-yl)benzamide;ethane is sourced from PubChem (CID 144714237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).