N-ethyl-2-oxocyclopentane-1-carboxamide

C8H13NO2 — CID 71371979

IUPACN-ethyl-2-oxocyclopentane-1-carboxamide
SMILESCCNC(=O)C1CCCC1=O
InChIInChI=1S/C8H13NO2/c1-2-9-8(11)6-4-3-5-7(6)10/h6H,2-5H2,1H3,(H,9,11)
InChIKeyFJWWMFHFNMYCPI-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.49
Rot. Bonds2

About N-ethyl-2-oxocyclopentane-1-carboxamide

N-ethyl-2-oxocyclopentane-1-carboxamide (PubChem CID 71371979) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is N-ethyl-2-oxocyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-ethyl-2-oxocyclopentane-1-carboxamide
PubChem CID71371979
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC NameN-ethyl-2-oxocyclopentane-1-carboxamide
SMILESCCNC(=O)C1CCCC1=O
InChIInChI=1S/C8H13NO2/c1-2-9-8(11)6-4-3-5-7(6)10/h6H,2-5H2,1H3,(H,9,11)
InChIKeyFJWWMFHFNMYCPI-UHFFFAOYSA-N
XLogP0.49
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-oxocyclopentane-1-carboxamide?
The IUPAC name of N-ethyl-2-oxocyclopentane-1-carboxamide (CID 71371979) is N-ethyl-2-oxocyclopentane-1-carboxamide.
What is the SMILES notation for N-ethyl-2-oxocyclopentane-1-carboxamide?
The canonical SMILES for N-ethyl-2-oxocyclopentane-1-carboxamide is CCNC(=O)C1CCCC1=O.
What is the InChIKey of N-ethyl-2-oxocyclopentane-1-carboxamide?
The InChIKey is FJWWMFHFNMYCPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-2-9-8(11)6-4-3-5-7(6)10/h6H,2-5H2,1H3,(H,9,11).
What are the key properties of N-ethyl-2-oxocyclopentane-1-carboxamide?
N-ethyl-2-oxocyclopentane-1-carboxamide has a molecular weight of 155.20 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-oxocyclopentane-1-carboxamide is sourced from PubChem (CID 71371979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).