4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide

C12H11ClN2O3 — CID 2363882

IUPAC4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide
SMILESO=C1CC[C@@H](NC(=O)c2ccc(Cl)cc2)C(=O)N1
InChIInChI=1S/C12H11ClN2O3/c13-8-3-1-7(2-4-8)11(17)14-9-5-6-10(16)15-12(9)18/h1-4,9H,5-6H2,(H,14,17)(H,15,16,18)/t9-/m1/s1
InChIKeyWZJABSNOIBPFBM-SECBINFHSA-N
MW266.68 g/mol
LogP0.88
Rot. Bonds2

About 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide

4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide (PubChem CID 2363882) has the molecular formula C12H11ClN2O3 and a molecular weight of 266.68 g/mol. Its IUPAC name is 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide
PubChem CID2363882
Molecular FormulaC12H11ClN2O3
Molecular Weight266.68 g/mol
Exact Mass266.05
IUPAC Name4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide
SMILESO=C1CC[C@@H](NC(=O)c2ccc(Cl)cc2)C(=O)N1
InChIInChI=1S/C12H11ClN2O3/c13-8-3-1-7(2-4-8)11(17)14-9-5-6-10(16)15-12(9)18/h1-4,9H,5-6H2,(H,14,17)(H,15,16,18)/t9-/m1/s1
InChIKeyWZJABSNOIBPFBM-SECBINFHSA-N
XLogP0.88
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.68
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,6-dioxopiperidin-3-yl)benzamide;ethane
CID 156866709
2-(4-chlorophenyl)-N-[(3S)-2,6-dioxopiperidin-3-yl]acetamide
CID 110186635
N-(2,6-dioxopiperidin-3-yl)-4-nitrobenzamide
CID 10378768
N-(2,6-dioxopiperidin-3-yl)-4-propylbenzamide
CID 168945690
N-(2,6-dioxopiperidin-3-yl)-4-ethylsulfonylbenzamide
CID 146124036
N-(2,6-dioxopiperidin-3-yl)-4-fluoro-3-methoxybenzamide
CID 81285163
4-chloro-N-(2-oxopiperidin-3-yl)benzamide
CID 3531239
2-chloro-N-(2,6-dioxopiperidin-3-yl)furan-3-carboxamide
CID 106686964
N-(2,6-dioxopiperidin-3-yl)-1,3-benzoxazole-5-carboxamide
CID 154810751
N-(2,6-dioxopiperidin-3-yl)-3-phenylbenzamide
CID 138467355
N-(2,5-dioxopyrrolidin-3-yl)-4-hydroxybenzamide
CID 110462643
N-[(3S)-2,6-dioxopiperidin-3-yl]-2-hydroxybenzamide
CID 141087093

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide?
The IUPAC name of 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide (CID 2363882) is 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide.
What is the SMILES notation for 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide?
The canonical SMILES for 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide is O=C1CC[C@@H](NC(=O)c2ccc(Cl)cc2)C(=O)N1.
What is the InChIKey of 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide?
The InChIKey is WZJABSNOIBPFBM-SECBINFHSA-N. The full InChI is InChI=1S/C12H11ClN2O3/c13-8-3-1-7(2-4-8)11(17)14-9-5-6-10(16)15-12(9)18/h1-4,9H,5-6H2,(H,14,17)(H,15,16,18)/t9-/m1/s1.
What are the key properties of 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide?
4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide has a molecular weight of 266.68 g/mol, XLogP of 0.88, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[(3R)-2,6-dioxopiperidin-3-yl]benzamide is sourced from PubChem (CID 2363882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).