4-ethyl-2-methyl-2-propyl-1,3-oxazolidine

C9H19NO — CID 139237407

IUPAC4-ethyl-2-methyl-2-propyl-1,3-oxazolidine
SMILESCCCC1(C)NC(CC)CO1
InChIInChI=1S/C9H19NO/c1-4-6-9(3)10-8(5-2)7-11-9/h8,10H,4-7H2,1-3H3
InChIKeyGBBOYILVSTUCLA-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.90
Rot. Bonds3

About 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine

4-ethyl-2-methyl-2-propyl-1,3-oxazolidine (PubChem CID 139237407) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine.

Molecular Properties

Compound Name4-ethyl-2-methyl-2-propyl-1,3-oxazolidine
PubChem CID139237407
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name4-ethyl-2-methyl-2-propyl-1,3-oxazolidine
SMILESCCCC1(C)NC(CC)CO1
InChIInChI=1S/C9H19NO/c1-4-6-9(3)10-8(5-2)7-11-9/h8,10H,4-7H2,1-3H3
InChIKeyGBBOYILVSTUCLA-UHFFFAOYSA-N
XLogP1.90
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine?
The IUPAC name of 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine (CID 139237407) is 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine.
What is the SMILES notation for 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine?
The canonical SMILES for 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine is CCCC1(C)NC(CC)CO1.
What is the InChIKey of 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine?
The InChIKey is GBBOYILVSTUCLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-4-6-9(3)10-8(5-2)7-11-9/h8,10H,4-7H2,1-3H3.
What are the key properties of 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine?
4-ethyl-2-methyl-2-propyl-1,3-oxazolidine has a molecular weight of 157.26 g/mol, XLogP of 1.90, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-methyl-2-propyl-1,3-oxazolidine is sourced from PubChem (CID 139237407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).