2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide

C11H19N3O3 — CID 21311653

IUPAC2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide
SMILESCC(=O)N(CC(=O)NC(C)C)N1CCCC1=O
InChIInChI=1S/C11H19N3O3/c1-8(2)12-10(16)7-14(9(3)15)13-6-4-5-11(13)17/h8H,4-7H2,1-3H3,(H,12,16)
InChIKeyNNPDYGQFNOAJHB-UHFFFAOYSA-N
MW241.29 g/mol
LogP-0.10
Rot. Bonds4

About 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide

2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide (PubChem CID 21311653) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide
PubChem CID21311653
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide
SMILESCC(=O)N(CC(=O)NC(C)C)N1CCCC1=O
InChIInChI=1S/C11H19N3O3/c1-8(2)12-10(16)7-14(9(3)15)13-6-4-5-11(13)17/h8H,4-7H2,1-3H3,(H,12,16)
InChIKeyNNPDYGQFNOAJHB-UHFFFAOYSA-N
XLogP-0.10
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide (CID 21311653) is 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide is CC(=O)N(CC(=O)NC(C)C)N1CCCC1=O.
What is the InChIKey of 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide?
The InChIKey is NNPDYGQFNOAJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-8(2)12-10(16)7-14(9(3)15)13-6-4-5-11(13)17/h8H,4-7H2,1-3H3,(H,12,16).
What are the key properties of 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide?
2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide has a molecular weight of 241.29 g/mol, XLogP of -0.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl-(2-oxopyrrolidin-1-yl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 21311653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).