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

C10H12N2O3 — CID 112731299

IUPACN-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide
SMILESO=C(CCN1C(=O)C=CC1=O)NC1CC1
InChIInChI=1S/C10H12N2O3/c13-8(11-7-1-2-7)5-6-12-9(14)3-4-10(12)15/h3-4,7H,1-2,5-6H2,(H,11,13)
InChIKeySBAFPJIRHJSOCI-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.42
Rot. Bonds4

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

N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide (PubChem CID 112731299) has the molecular formula C10H12N2O3 and a molecular weight of 208.22 g/mol. Its IUPAC name is N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide
PubChem CID112731299
Molecular FormulaC10H12N2O3
Molecular Weight208.22 g/mol
Exact Mass208.08
IUPAC NameN-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide
SMILESO=C(CCN1C(=O)C=CC1=O)NC1CC1
InChIInChI=1S/C10H12N2O3/c13-8(11-7-1-2-7)5-6-12-9(14)3-4-10(12)15/h3-4,7H,1-2,5-6H2,(H,11,13)
InChIKeySBAFPJIRHJSOCI-UHFFFAOYSA-N
XLogP-0.42
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 60667695
6-(2,5-dioxopyrrol-1-yl)-N-piperidin-4-ylhexanamide
CID 176889456
N-cyclopropyl-3-(4,7-dimethyl-2,3-dioxoindol-1-yl)propanamide
CID 62628305
N,N'-dicyclopropylbutanediamide
CID 5225156
N-cyclopropyl-3-(3,4-dihydroxypyrrolidin-1-yl)propanamide
CID 106672855
3-[(1R,2R,6R,7R)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-N-(4-methylcyclohexyl)propanamide
CID 98613004
3-[(1R,2R,6S,7S)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-N-(4-methylcyclohexyl)propanamide
CID 11859382
4-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]butanoic acid
CID 146519750
N-cycloheptyl-3-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)propanamide
CID 17409825
N-cyclohexyl-3-(5,6-dichloro-1,3-dioxoisoindol-2-yl)propanamide
CID 9172413
1-[3-(cyclopropylamino)-3-oxopropyl]-5-oxopyrrolidine-2-carboxylic acid
CID 62874003
1-[3-(cyclopropylamino)-3-oxopropyl]-6-oxopyridine-2-carboxylic acid
CID 114040167

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide?
The IUPAC name of N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide (CID 112731299) is N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide.
What is the SMILES notation for N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide?
The canonical SMILES for N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide is O=C(CCN1C(=O)C=CC1=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide?
The InChIKey is SBAFPJIRHJSOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O3/c13-8(11-7-1-2-7)5-6-12-9(14)3-4-10(12)15/h3-4,7H,1-2,5-6H2,(H,11,13).
What are the key properties of N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide?
N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide has a molecular weight of 208.22 g/mol, XLogP of -0.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(2,5-dioxopyrrol-1-yl)propanamide is sourced from PubChem (CID 112731299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).