N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide

C13H22N2O2 — CID 83192551

IUPACN-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCC1CCC(NC(=O)C2CNC(=O)C2)C1C
InChIInChI=1S/C13H22N2O2/c1-3-9-4-5-11(8(9)2)15-13(17)10-6-12(16)14-7-10/h8-11H,3-7H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyBSWIHQHDCGFLLH-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.06
Rot. Bonds3

About N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide

N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 83192551) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID83192551
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC NameN-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCC1CCC(NC(=O)C2CNC(=O)C2)C1C
InChIInChI=1S/C13H22N2O2/c1-3-9-4-5-11(8(9)2)15-13(17)10-6-12(16)14-7-10/h8-11H,3-7H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyBSWIHQHDCGFLLH-UHFFFAOYSA-N
XLogP1.06
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide (CID 83192551) is N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide is CCC1CCC(NC(=O)C2CNC(=O)C2)C1C.
What is the InChIKey of N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is BSWIHQHDCGFLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-3-9-4-5-11(8(9)2)15-13(17)10-6-12(16)14-7-10/h8-11H,3-7H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide?
N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-2-methylcyclopentyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 83192551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).