N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide

C12H20N2O2 — CID 79544614

IUPACN,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide
SMILESCN(C)C(=O)N1CCCC1C1CCCC1=O
InChIInChI=1S/C12H20N2O2/c1-13(2)12(16)14-8-4-6-10(14)9-5-3-7-11(9)15/h9-10H,3-8H2,1-2H3
InChIKeyIPAUVPVKXXMYTK-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.50
Rot. Bonds1

About N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide

N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide (PubChem CID 79544614) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide
PubChem CID79544614
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC NameN,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide
SMILESCN(C)C(=O)N1CCCC1C1CCCC1=O
InChIInChI=1S/C12H20N2O2/c1-13(2)12(16)14-8-4-6-10(14)9-5-3-7-11(9)15/h9-10H,3-8H2,1-2H3
InChIKeyIPAUVPVKXXMYTK-UHFFFAOYSA-N
XLogP1.50
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide (CID 79544614) is N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide is CN(C)C(=O)N1CCCC1C1CCCC1=O.
What is the InChIKey of N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide?
The InChIKey is IPAUVPVKXXMYTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-13(2)12(16)14-8-4-6-10(14)9-5-3-7-11(9)15/h9-10H,3-8H2,1-2H3.
What are the key properties of N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide?
N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide has a molecular weight of 224.30 g/mol, XLogP of 1.50, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-oxocyclopentyl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 79544614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).