3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine

C8H17NO — CID 171417433

IUPAC3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine
SMILESCC(C)C1(C)COCN1C
InChIInChI=1S/C8H17NO/c1-7(2)8(3)5-10-6-9(8)4/h7H,5-6H2,1-4H3
InChIKeyHOFZOWGTOFGDEO-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.32
Rot. Bonds1

About 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine

3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine (PubChem CID 171417433) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine.

Molecular Properties

Compound Name3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine
PubChem CID171417433
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine
SMILESCC(C)C1(C)COCN1C
InChIInChI=1S/C8H17NO/c1-7(2)8(3)5-10-6-9(8)4/h7H,5-6H2,1-4H3
InChIKeyHOFZOWGTOFGDEO-UHFFFAOYSA-N
XLogP1.32
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine?
The IUPAC name of 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine (CID 171417433) is 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine.
What is the SMILES notation for 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine?
The canonical SMILES for 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine is CC(C)C1(C)COCN1C.
What is the InChIKey of 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine?
The InChIKey is HOFZOWGTOFGDEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)8(3)5-10-6-9(8)4/h7H,5-6H2,1-4H3.
What are the key properties of 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine?
3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine has a molecular weight of 143.23 g/mol, XLogP of 1.32, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-4-propan-2-yl-1,3-oxazolidine is sourced from PubChem (CID 171417433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).