2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide

C10H14N2O3 — CID 58493132

IUPAC2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)N1C(=O)C=CC1=O
InChIInChI=1S/C10H14N2O3/c1-6(2)11-10(15)7(3)12-8(13)4-5-9(12)14/h4-7H,1-3H3,(H,11,15)
InChIKeyUTFOZEPNHLCQQO-UHFFFAOYSA-N
MW210.23 g/mol
LogP-0.18
Rot. Bonds3

About 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide

2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide (PubChem CID 58493132) has the molecular formula C10H14N2O3 and a molecular weight of 210.23 g/mol. Its IUPAC name is 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide
PubChem CID58493132
Molecular FormulaC10H14N2O3
Molecular Weight210.23 g/mol
Exact Mass210.10
IUPAC Name2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)C(C)N1C(=O)C=CC1=O
InChIInChI=1S/C10H14N2O3/c1-6(2)11-10(15)7(3)12-8(13)4-5-9(12)14/h4-7H,1-3H3,(H,11,15)
InChIKeyUTFOZEPNHLCQQO-UHFFFAOYSA-N
XLogP-0.18
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
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 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide (CID 58493132) is 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide is CC(C)NC(=O)C(C)N1C(=O)C=CC1=O.
What is the InChIKey of 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide?
The InChIKey is UTFOZEPNHLCQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O3/c1-6(2)11-10(15)7(3)12-8(13)4-5-9(12)14/h4-7H,1-3H3,(H,11,15).
What are the key properties of 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide?
2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide has a molecular weight of 210.23 g/mol, XLogP of -0.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxopyrrol-1-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 58493132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).