2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine

C9H13NO2 — CID 117228961

IUPAC2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine
SMILESCC1CNC(C)(c2ccco2)O1
InChIInChI=1S/C9H13NO2/c1-7-6-10-9(2,12-7)8-4-3-5-11-8/h3-5,7,10H,6H2,1-2H3
InChIKeyWDLPEJZPLYOHQS-UHFFFAOYSA-N
MW167.21 g/mol
LogP1.46
Rot. Bonds1

About 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine

2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine (PubChem CID 117228961) has the molecular formula C9H13NO2 and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine.

Molecular Properties

Compound Name2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine
PubChem CID117228961
Molecular FormulaC9H13NO2
Molecular Weight167.21 g/mol
Exact Mass167.09
IUPAC Name2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine
SMILESCC1CNC(C)(c2ccco2)O1
InChIInChI=1S/C9H13NO2/c1-7-6-10-9(2,12-7)8-4-3-5-11-8/h3-5,7,10H,6H2,1-2H3
InChIKeyWDLPEJZPLYOHQS-UHFFFAOYSA-N
XLogP1.46
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine?
The IUPAC name of 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine (CID 117228961) is 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine.
What is the SMILES notation for 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine?
The canonical SMILES for 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine is CC1CNC(C)(c2ccco2)O1.
What is the InChIKey of 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine?
The InChIKey is WDLPEJZPLYOHQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO2/c1-7-6-10-9(2,12-7)8-4-3-5-11-8/h3-5,7,10H,6H2,1-2H3.
What are the key properties of 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine?
2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine has a molecular weight of 167.21 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-2,5-dimethyl-1,3-oxazolidine is sourced from PubChem (CID 117228961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).