(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate

C11H16N2O3 — CID 118728308

IUPAC(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1cc(C2CCCC2)on1
InChIInChI=1S/C11H16N2O3/c1-13(2)11(14)15-10-7-9(16-12-10)8-5-3-4-6-8/h7-8H,3-6H2,1-2H3
InChIKeyLCTKLBIKLDIDCL-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.39
Rot. Bonds2

About (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate

(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate (PubChem CID 118728308) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate.

Molecular Properties

Compound Name(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate
PubChem CID118728308
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate
SMILESCN(C)C(=O)Oc1cc(C2CCCC2)on1
InChIInChI=1S/C11H16N2O3/c1-13(2)11(14)15-10-7-9(16-12-10)8-5-3-4-6-8/h7-8H,3-6H2,1-2H3
InChIKeyLCTKLBIKLDIDCL-UHFFFAOYSA-N
XLogP2.39
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate?
The IUPAC name of (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate (CID 118728308) is (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate.
What is the SMILES notation for (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate?
The canonical SMILES for (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate is CN(C)C(=O)Oc1cc(C2CCCC2)on1.
What is the InChIKey of (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate?
The InChIKey is LCTKLBIKLDIDCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-13(2)11(14)15-10-7-9(16-12-10)8-5-3-4-6-8/h7-8H,3-6H2,1-2H3.
What are the key properties of (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate?
(5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate has a molecular weight of 224.26 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-cyclopentyl-1,2-oxazol-3-yl) N,N-dimethylcarbamate is sourced from PubChem (CID 118728308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).