2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine

C10H19NO2 — CID 117227702

IUPAC2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine
SMILESCC1COC(C)(CC2CCOC2)N1
InChIInChI=1S/C10H19NO2/c1-8-6-13-10(2,11-8)5-9-3-4-12-7-9/h8-9,11H,3-7H2,1-2H3
InChIKeyRRDCEOYEKDLTJV-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.14
Rot. Bonds2

About 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine

2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine (PubChem CID 117227702) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine
PubChem CID117227702
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine
SMILESCC1COC(C)(CC2CCOC2)N1
InChIInChI=1S/C10H19NO2/c1-8-6-13-10(2,11-8)5-9-3-4-12-7-9/h8-9,11H,3-7H2,1-2H3
InChIKeyRRDCEOYEKDLTJV-UHFFFAOYSA-N
XLogP1.14
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine?
The IUPAC name of 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine (CID 117227702) is 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine.
What is the SMILES notation for 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine?
The canonical SMILES for 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine is CC1COC(C)(CC2CCOC2)N1.
What is the InChIKey of 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine?
The InChIKey is RRDCEOYEKDLTJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-8-6-13-10(2,11-8)5-9-3-4-12-7-9/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine?
2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine has a molecular weight of 185.27 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazolidine is sourced from PubChem (CID 117227702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).