2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide

C14H22N2O2 — CID 79544172

IUPAC2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1CCCC1C1CCCC1=O
InChIInChI=1S/C14H22N2O2/c1-2-8-15-14(18)10-16-9-4-6-12(16)11-5-3-7-13(11)17/h2,11-12H,1,3-10H2,(H,15,18)
InChIKeyQGCHUSOTGGROEG-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.12
Rot. Bonds5

About 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide

2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide (PubChem CID 79544172) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide.

Molecular Properties

Compound Name2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide
PubChem CID79544172
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide
SMILESC=CCNC(=O)CN1CCCC1C1CCCC1=O
InChIInChI=1S/C14H22N2O2/c1-2-8-15-14(18)10-16-9-4-6-12(16)11-5-3-7-13(11)17/h2,11-12H,1,3-10H2,(H,15,18)
InChIKeyQGCHUSOTGGROEG-UHFFFAOYSA-N
XLogP1.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2-oxocyclopentyl)piperidin-1-yl]-N-propylacetamide
CID 79545157
N-ethyl-2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
CID 79552796
N-cyclohexyl-2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]acetamide
CID 79535803
N-methyl-2-[2-(2-oxocyclopentyl)piperidin-1-yl]acetamide
CID 79544652
N-tert-butyl-2-[2-(2-oxocyclohexyl)pyrrolidin-1-yl]acetamide
CID 79548763
N-prop-2-enyl-2-(2-pyrrolidin-2-ylpiperidin-1-yl)acetamide
CID 63256782
N-(2-methylbutan-2-yl)-2-[2-(2-oxocyclohexyl)pyrrolidin-1-yl]acetamide
CID 79536402
2-[1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrrolidin-2-yl]cyclopentan-1-one
CID 79535797
2-[2-(2-oxocyclohexyl)piperidin-1-yl]acetamide
CID 79552802
2-(1-ethylpyrrolidin-2-yl)cyclopentan-1-one
CID 79543714
1-[2-oxo-2-(prop-2-enylamino)ethyl]azepane-2-carboxylic acid
CID 64562180
2-[1-(2,2,2-trifluoroethyl)pyrrolidin-2-yl]cyclopentan-1-one
CID 79544634

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide?
The IUPAC name of 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide (CID 79544172) is 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide.
What is the SMILES notation for 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide?
The canonical SMILES for 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide is C=CCNC(=O)CN1CCCC1C1CCCC1=O.
What is the InChIKey of 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide?
The InChIKey is QGCHUSOTGGROEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-2-8-15-14(18)10-16-9-4-6-12(16)11-5-3-7-13(11)17/h2,11-12H,1,3-10H2,(H,15,18).
What are the key properties of 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide?
2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide has a molecular weight of 250.34 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-oxocyclopentyl)pyrrolidin-1-yl]-N-prop-2-enylacetamide is sourced from PubChem (CID 79544172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).