ethane;5-methyl-1,3-oxazolidine

C6H15NO — CID 70619826

IUPACethane;5-methyl-1,3-oxazolidine
SMILESCC.CC1CNCO1
InChIInChI=1S/C4H9NO.C2H6/c1-4-2-5-3-6-4;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyUNSUAIKOXAUAII-UHFFFAOYSA-N
MW117.19 g/mol
LogP0.98
Rot. Bonds

About ethane;5-methyl-1,3-oxazolidine

ethane;5-methyl-1,3-oxazolidine (PubChem CID 70619826) has the molecular formula C6H15NO and a molecular weight of 117.19 g/mol. Its IUPAC name is ethane;5-methyl-1,3-oxazolidine.

Molecular Properties

Compound Nameethane;5-methyl-1,3-oxazolidine
PubChem CID70619826
Molecular FormulaC6H15NO
Molecular Weight117.19 g/mol
Exact Mass117.12
IUPAC Nameethane;5-methyl-1,3-oxazolidine
SMILESCC.CC1CNCO1
InChIInChI=1S/C4H9NO.C2H6/c1-4-2-5-3-6-4;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyUNSUAIKOXAUAII-UHFFFAOYSA-N
XLogP0.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.19
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;5-methyl-1,3-oxazolidine?
The IUPAC name of ethane;5-methyl-1,3-oxazolidine (CID 70619826) is ethane;5-methyl-1,3-oxazolidine.
What is the SMILES notation for ethane;5-methyl-1,3-oxazolidine?
The canonical SMILES for ethane;5-methyl-1,3-oxazolidine is CC.CC1CNCO1.
What is the InChIKey of ethane;5-methyl-1,3-oxazolidine?
The InChIKey is UNSUAIKOXAUAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO.C2H6/c1-4-2-5-3-6-4;1-2/h4-5H,2-3H2,1H3;1-2H3.
What are the key properties of ethane;5-methyl-1,3-oxazolidine?
ethane;5-methyl-1,3-oxazolidine has a molecular weight of 117.19 g/mol, XLogP of 0.98, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methyl-1,3-oxazolidine is sourced from PubChem (CID 70619826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).