2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine

C12H20N2O2 — CID 105482172

IUPAC2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine
SMILESCc1oc(C(C)(C)C)nc1C1CNCCO1
InChIInChI=1S/C12H20N2O2/c1-8-10(9-7-13-5-6-15-9)14-11(16-8)12(2,3)4/h9,13H,5-7H2,1-4H3
InChIKeyZWRBOAFJRVZJHG-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.94
Rot. Bonds1

About 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine

2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine (PubChem CID 105482172) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine.

Molecular Properties

Compound Name2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine
PubChem CID105482172
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine
SMILESCc1oc(C(C)(C)C)nc1C1CNCCO1
InChIInChI=1S/C12H20N2O2/c1-8-10(9-7-13-5-6-15-9)14-11(16-8)12(2,3)4/h9,13H,5-7H2,1-4H3
InChIKeyZWRBOAFJRVZJHG-UHFFFAOYSA-N
XLogP1.94
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-cyclopropyl-5-methyl-1,3-oxazol-4-yl)morpholine
CID 105461830
2-(5-tert-butyl-1,3,4-oxadiazol-2-yl)morpholine
CID 105465022
2-(4-tert-butyl-2,6-dimethylphenyl)morpholine
CID 82296070
2-(4-tert-butyl-1,3-oxazol-2-yl)morpholine
CID 105464187
(2S)-2-(4-tert-butyl-1,3-thiazol-2-yl)morpholine
CID 94782519
2-(5-tert-butyl-2-methyl-1,2,4-triazol-3-yl)morpholine
CID 62720908
2-(6-tert-butylpyridazin-3-yl)morpholine
CID 140941619
2-(1,4-dimethylpyrazol-3-yl)morpholine
CID 131585478
(2R)-2-(5-methyl-1H-pyrazol-3-yl)morpholine
CID 96740317
2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)morpholine
CID 79796200
2-(6-methyl-7H-purin-8-yl)morpholine
CID 155375923
(5-methyl-2-morpholin-2-yl-1,3-thiazol-4-yl)methanol
CID 175330057

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine?
The IUPAC name of 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine (CID 105482172) is 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine.
What is the SMILES notation for 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine?
The canonical SMILES for 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine is Cc1oc(C(C)(C)C)nc1C1CNCCO1.
What is the InChIKey of 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine?
The InChIKey is ZWRBOAFJRVZJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-8-10(9-7-13-5-6-15-9)14-11(16-8)12(2,3)4/h9,13H,5-7H2,1-4H3.
What are the key properties of 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine?
2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine has a molecular weight of 224.30 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-5-methyl-1,3-oxazol-4-yl)morpholine is sourced from PubChem (CID 105482172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).