N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide

C10H14N2O3 — CID 60976863

IUPACN,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide
SMILESCC1=CC(=O)N(C(C)C(=O)N(C)C)C1=O
InChIInChI=1S/C10H14N2O3/c1-6-5-8(13)12(9(6)14)7(2)10(15)11(3)4/h5,7H,1-4H3
InChIKeyNPSUCKSHMZPFKE-UHFFFAOYSA-N
MW210.23 g/mol
LogP-0.22
Rot. Bonds2

About N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide

N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide (PubChem CID 60976863) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide
PubChem CID60976863
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC NameN,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide
SMILESCC1=CC(=O)N(C(C)C(=O)N(C)C)C1=O
InChIInChI=1S/C10H14N2O3/c1-6-5-8(13)12(9(6)14)7(2)10(15)11(3)4/h5,7H,1-4H3
InChIKeyNPSUCKSHMZPFKE-UHFFFAOYSA-N
XLogP-0.22
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 5-0.22
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

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CID 5368010
Cropropamide
CID 5369258
Propylbutamide
CID 19064
N-(1-(dimethylamino)-1-oxobutan-2-yl)-N-ethylbut-2-enamide
CID 71217
3-Methyl-1-propylpyrrole-2,5-dione
CID 15697210
Crotonamide, N-(1-(diethylcarbamoyl)propyl)-N-ethyl-
CID 137321743
3-Methyl-1-[2-(3-methyl-2,5-dioxopyrrol-1-yl)ethyl]pyrrole-2,5-dione
CID 19967614
3-Methyl-1-[2-(3-methyl-2,5-dioxopyrrol-1-yl)propyl]pyrrole-2,5-dione
CID 19968759
3-Methyl-1-(2-oxopropyl)pyrrole-2,5-dione
CID 20692340
1-Butan-2-yl-3-methylpyrrole-2,5-dione
CID 43167740
1-Isopropyl-3-methyl-1H-pyrrole-2,5-dione
CID 43167744
1-[3-(Dimethylamino)propyl]-3-methylpyrrole-2,5-dione
CID 43346029

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide?
The IUPAC name of N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide (CID 60976863) is N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide.
What is the SMILES notation for N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide?
The canonical SMILES for N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide is CC1=CC(=O)N(C(C)C(=O)N(C)C)C1=O.
What is the InChIKey of N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide?
The InChIKey is NPSUCKSHMZPFKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6-5-8(13)12(9(6)14)7(2)10(15)11(3)4/h5,7H,1-4H3.
What are the key properties of N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide?
N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide has a molecular weight of 210.23 g/mol, XLogP of -0.22, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3-methyl-2,5-dioxopyrrol-1-yl)propanamide is sourced from PubChem (CID 60976863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).