cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone

C12H19NO2 — CID 86779488

IUPACcyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone
SMILESCC1OCCN(C(=O)C2=CCCC2)C1C
InChIInChI=1S/C12H19NO2/c1-9-10(2)15-8-7-13(9)12(14)11-5-3-4-6-11/h5,9-10H,3-4,6-8H2,1-2H3
InChIKeyIUKBZDUUVIHMRC-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.73
Rot. Bonds1

About cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone

cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone (PubChem CID 86779488) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone.

Molecular Properties

Compound Namecyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone
PubChem CID86779488
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Namecyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone
SMILESCC1OCCN(C(=O)C2=CCCC2)C1C
InChIInChI=1S/C12H19NO2/c1-9-10(2)15-8-7-13(9)12(14)11-5-3-4-6-11/h5,9-10H,3-4,6-8H2,1-2H3
InChIKeyIUKBZDUUVIHMRC-UHFFFAOYSA-N
XLogP1.73
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone?
The IUPAC name of cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone (CID 86779488) is cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone.
What is the SMILES notation for cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone?
The canonical SMILES for cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone is CC1OCCN(C(=O)C2=CCCC2)C1C.
What is the InChIKey of cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone?
The InChIKey is IUKBZDUUVIHMRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-9-10(2)15-8-7-13(9)12(14)11-5-3-4-6-11/h5,9-10H,3-4,6-8H2,1-2H3.
What are the key properties of cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone?
cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone has a molecular weight of 209.29 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenten-1-yl-(2,3-dimethylmorpholin-4-yl)methanone is sourced from PubChem (CID 86779488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).