6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine

C15H26N2O2S — CID 114775626

IUPAC6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COCc2nc(C(C)(C)C)cs2)O1
InChIInChI=1S/C15H26N2O2S/c1-14(2,3)12-9-20-13(17-12)8-18-7-11-6-16-10-15(4,5)19-11/h9,11,16H,6-8,10H2,1-5H3
InChIKeyZDRASWKPGTYPEE-UHFFFAOYSA-N
MW298.45 g/mol
LogP2.72
Rot. Bonds4

About 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine

6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine (PubChem CID 114775626) has the molecular formula C15H26N2O2S and a molecular weight of 298.45 g/mol. Its IUPAC name is 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine.

Molecular Properties

Compound Name6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine
PubChem CID114775626
Molecular FormulaC15H26N2O2S
Molecular Weight298.45 g/mol
Exact Mass298.17
IUPAC Name6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine
SMILESCC1(C)CNCC(COCc2nc(C(C)(C)C)cs2)O1
InChIInChI=1S/C15H26N2O2S/c1-14(2,3)12-9-20-13(17-12)8-18-7-11-6-16-10-15(4,5)19-11/h9,11,16H,6-8,10H2,1-5H3
InChIKeyZDRASWKPGTYPEE-UHFFFAOYSA-N
XLogP2.72
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.45
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(1-benzothiophen-3-ylmethoxymethyl)-2,2-dimethylmorpholine
CID 114775576
2,2-dimethyl-6-[(5-methyl-1,2-oxazol-3-yl)methoxymethyl]morpholine
CID 114775307
6-[(4-chloro-1,3-thiazol-2-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775902
6-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775371
2,2-dimethyl-6-[(3-propan-2-ylimidazol-4-yl)methoxymethyl]morpholine
CID 106939028
6-[(2-methoxy-3-pyridinyl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775440
4-tert-butyl-2-(2,2,2-trifluoroethoxymethyl)-1,3-thiazole
CID 104932543
6-[(3-methoxyphenyl)methoxymethyl]-2,2-dimethylmorpholine
CID 114775645
2-[2-(4-tert-butyl-1,3-thiazol-2-yl)ethyl]morpholine
CID 116969136
6-[(3-chloro-2-fluorophenyl)methoxymethyl]-2,2-dimethylmorpholine
CID 102856484
2,2-dimethyl-6-[[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]oxymethyl]morpholine
CID 107305928
2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine
CID 114775795

Frequently Asked Questions

What is the IUPAC name of 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine?
The IUPAC name of 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine (CID 114775626) is 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine.
What is the SMILES notation for 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine?
The canonical SMILES for 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine is CC1(C)CNCC(COCc2nc(C(C)(C)C)cs2)O1.
What is the InChIKey of 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine?
The InChIKey is ZDRASWKPGTYPEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S/c1-14(2,3)12-9-20-13(17-12)8-18-7-11-6-16-10-15(4,5)19-11/h9,11,16H,6-8,10H2,1-5H3.
What are the key properties of 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine?
6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine has a molecular weight of 298.45 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-tert-butyl-1,3-thiazol-2-yl)methoxymethyl]-2,2-dimethylmorpholine is sourced from PubChem (CID 114775626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).