N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide

C12H20N2O2 — CID 3267084

IUPACN-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide
SMILESO=C(NC1CCCCC1)C(=O)N1CCCC1
InChIInChI=1S/C12H20N2O2/c15-11(12(16)14-8-4-5-9-14)13-10-6-2-1-3-7-10/h10H,1-9H2,(H,13,15)
InChIKeyGHMLEEWTMIUKJX-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.06
Rot. Bonds1

About N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide

N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide (PubChem CID 3267084) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide
PubChem CID3267084
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide
SMILESO=C(NC1CCCCC1)C(=O)N1CCCC1
InChIInChI=1S/C12H20N2O2/c15-11(12(16)14-8-4-5-9-14)13-10-6-2-1-3-7-10/h10H,1-9H2,(H,13,15)
InChIKeyGHMLEEWTMIUKJX-UHFFFAOYSA-N
XLogP1.06
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide (CID 3267084) is N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide is O=C(NC1CCCCC1)C(=O)N1CCCC1.
What is the InChIKey of N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide?
The InChIKey is GHMLEEWTMIUKJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c15-11(12(16)14-8-4-5-9-14)13-10-6-2-1-3-7-10/h10H,1-9H2,(H,13,15).
What are the key properties of N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide?
N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide has a molecular weight of 224.30 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-oxo-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 3267084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).