2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide

C11H20N2O2 — CID 59945974

IUPAC2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide
SMILESCC(=O)[C@H]1CCCN1CC(=O)NC(C)C
InChIInChI=1S/C11H20N2O2/c1-8(2)12-11(15)7-13-6-4-5-10(13)9(3)14/h8,10H,4-7H2,1-3H3,(H,12,15)/t10-/m1/s1
InChIKeyIRNFKOCMZURMEV-SNVBAGLBSA-N
MW212.29 g/mol
LogP0.56
Rot. Bonds4

About 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide

2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide (PubChem CID 59945974) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide
PubChem CID59945974
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide
SMILESCC(=O)[C@H]1CCCN1CC(=O)NC(C)C
InChIInChI=1S/C11H20N2O2/c1-8(2)12-11(15)7-13-6-4-5-10(13)9(3)14/h8,10H,4-7H2,1-3H3,(H,12,15)/t10-/m1/s1
InChIKeyIRNFKOCMZURMEV-SNVBAGLBSA-N
XLogP0.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide (CID 59945974) is 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide is CC(=O)[C@H]1CCCN1CC(=O)NC(C)C.
What is the InChIKey of 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide?
The InChIKey is IRNFKOCMZURMEV-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-8(2)12-11(15)7-13-6-4-5-10(13)9(3)14/h8,10H,4-7H2,1-3H3,(H,12,15)/t10-/m1/s1.
What are the key properties of 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide?
2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide has a molecular weight of 212.29 g/mol, XLogP of 0.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-acetylpyrrolidin-1-yl]-N-propan-2-ylacetamide is sourced from PubChem (CID 59945974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).