2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine

C9H19NO2 — CID 167089672

IUPAC2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine
SMILESCC(C)OCC1CN(C)C(C)O1
InChIInChI=1S/C9H19NO2/c1-7(2)11-6-9-5-10(4)8(3)12-9/h7-9H,5-6H2,1-4H3
InChIKeyDPLPRQMNUGNWTC-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.09
Rot. Bonds3

About 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine

2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine (PubChem CID 167089672) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine
PubChem CID167089672
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine
SMILESCC(C)OCC1CN(C)C(C)O1
InChIInChI=1S/C9H19NO2/c1-7(2)11-6-9-5-10(4)8(3)12-9/h7-9H,5-6H2,1-4H3
InChIKeyDPLPRQMNUGNWTC-UHFFFAOYSA-N
XLogP1.09
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine?
The IUPAC name of 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine (CID 167089672) is 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine.
What is the SMILES notation for 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine?
The canonical SMILES for 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine is CC(C)OCC1CN(C)C(C)O1.
What is the InChIKey of 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine?
The InChIKey is DPLPRQMNUGNWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-7(2)11-6-9-5-10(4)8(3)12-9/h7-9H,5-6H2,1-4H3.
What are the key properties of 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine?
2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine has a molecular weight of 173.26 g/mol, XLogP of 1.09, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-(propan-2-yloxymethyl)-1,3-oxazolidine is sourced from PubChem (CID 167089672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).