N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide

C8H12N2O3 — CID 13034093

IUPACN-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide
SMILESCC(=O)N(C)CN1C(=O)CCC1=O
InChIInChI=1S/C8H12N2O3/c1-6(11)9(2)5-10-7(12)3-4-8(10)13/h3-5H2,1-2H3
InChIKeyJAMDFKVRHZENDW-UHFFFAOYSA-N
MW184.19 g/mol
LogP-0.43
Rot. Bonds2

About N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide

N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide (PubChem CID 13034093) has the molecular formula C8H12N2O3 and a molecular weight of 184.19 g/mol. Its IUPAC name is N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide.

Molecular Properties

Compound NameN-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide
PubChem CID13034093
Molecular FormulaC8H12N2O3
Molecular Weight184.19 g/mol
Exact Mass184.08
IUPAC NameN-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide
SMILESCC(=O)N(C)CN1C(=O)CCC1=O
InChIInChI=1S/C8H12N2O3/c1-6(11)9(2)5-10-7(12)3-4-8(10)13/h3-5H2,1-2H3
InChIKeyJAMDFKVRHZENDW-UHFFFAOYSA-N
XLogP-0.43
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.19
LogP ≤ 5-0.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-Oxo-1-pyrrolidinecarboxamide
CID 326996
Succinimide, N-(4-methyl-1-piperazinylmethyl)-
CID 217171
Succinimide, N-((dimethylamino)methyl)-
CID 217169
1,1'-Ethylidenedi-2-pyrrolidinone
CID 13379697
1-[(2-Oxopyrrolidinyl)methyl]pyrrolidin-2-one
CID 4159826
N,N'-Carbonyldipyrrolidin-2-one
CID 533467
1,1'-[(Methylazanediyl)bis(methylene)]di(pyrrolidine-2,5-dione)
CID 339370
N,N-bis[(2,5-dioxopyrrolidin-1-yl)methyl]acetamide
CID 3588259
Disuccinimidomethan
CID 20071048
Bissuccinimidoethane
CID 129711359
2-Pyrrolidinone, 1-[(diethylamino)methyl]-
CID 4737447
N-(succinimidomethyl)diisobutylamine
CID 15532095

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide?
The IUPAC name of N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide (CID 13034093) is N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide.
What is the SMILES notation for N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide?
The canonical SMILES for N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide is CC(=O)N(C)CN1C(=O)CCC1=O.
What is the InChIKey of N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide?
The InChIKey is JAMDFKVRHZENDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O3/c1-6(11)9(2)5-10-7(12)3-4-8(10)13/h3-5H2,1-2H3.
What are the key properties of N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide?
N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide has a molecular weight of 184.19 g/mol, XLogP of -0.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-dioxopyrrolidin-1-yl)methyl]-N-methylacetamide is sourced from PubChem (CID 13034093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).