N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide

C10H16N2O3 — CID 124508490

IUPACN-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)N[C@H]1CCC(=O)NC1=O
InChIInChI=1S/C10H16N2O3/c1-10(2,3)9(15)11-6-4-5-7(13)12-8(6)14/h6H,4-5H2,1-3H3,(H,11,15)(H,12,13,14)/t6-/m0/s1
InChIKeyCYFLDDLPDPLZIT-LURJTMIESA-N
MW212.25 g/mol
LogP-0.05
Rot. Bonds1

About N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide

N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide (PubChem CID 124508490) has the molecular formula C10H16N2O3 and a molecular weight of 212.25 g/mol. Its IUPAC name is N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide
PubChem CID124508490
Molecular FormulaC10H16N2O3
Molecular Weight212.25 g/mol
Exact Mass212.12
IUPAC NameN-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)N[C@H]1CCC(=O)NC1=O
InChIInChI=1S/C10H16N2O3/c1-10(2,3)9(15)11-6-4-5-7(13)12-8(6)14/h6H,4-5H2,1-3H3,(H,11,15)(H,12,13,14)/t6-/m0/s1
InChIKeyCYFLDDLPDPLZIT-LURJTMIESA-N
XLogP-0.05
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide?
The IUPAC name of N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide (CID 124508490) is N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)N[C@H]1CCC(=O)NC1=O.
What is the InChIKey of N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide?
The InChIKey is CYFLDDLPDPLZIT-LURJTMIESA-N. The full InChI is InChI=1S/C10H16N2O3/c1-10(2,3)9(15)11-6-4-5-7(13)12-8(6)14/h6H,4-5H2,1-3H3,(H,11,15)(H,12,13,14)/t6-/m0/s1.
What are the key properties of N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide?
N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide has a molecular weight of 212.25 g/mol, XLogP of -0.05, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-2,6-dioxopiperidin-3-yl]-2,2-dimethylpropanamide is sourced from PubChem (CID 124508490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).