1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one

C11H14N2O2 — CID 142624811

IUPAC1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one
SMILESCc1noc(C2CC2)c1N1CCCC1=O
InChIInChI=1S/C11H14N2O2/c1-7-10(13-6-2-3-9(13)14)11(15-12-7)8-4-5-8/h8H,2-6H2,1H3
InChIKeyYFVZVLPDWQLWJA-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.99
Rot. Bonds2

About 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one

1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one (PubChem CID 142624811) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one
PubChem CID142624811
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one
SMILESCc1noc(C2CC2)c1N1CCCC1=O
InChIInChI=1S/C11H14N2O2/c1-7-10(13-6-2-3-9(13)14)11(15-12-7)8-4-5-8/h8H,2-6H2,1H3
InChIKeyYFVZVLPDWQLWJA-UHFFFAOYSA-N
XLogP1.99
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one?
The IUPAC name of 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one (CID 142624811) is 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one is Cc1noc(C2CC2)c1N1CCCC1=O.
What is the InChIKey of 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one?
The InChIKey is YFVZVLPDWQLWJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-7-10(13-6-2-3-9(13)14)11(15-12-7)8-4-5-8/h8H,2-6H2,1H3.
What are the key properties of 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one?
1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one has a molecular weight of 206.24 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-3-methyl-1,2-oxazol-4-yl)pyrrolidin-2-one is sourced from PubChem (CID 142624811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).