[2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol

C9H14N2O2S — CID 79086066

IUPAC[2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol
SMILESCN1CCOC(c2ncc(CO)s2)C1
InChIInChI=1S/C9H14N2O2S/c1-11-2-3-13-8(5-11)9-10-4-7(6-12)14-9/h4,8,12H,2-3,5-6H2,1H3
InChIKeyQCIAGFNECTVGES-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.64
Rot. Bonds2

About [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol

[2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 79086066) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol
PubChem CID79086066
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name[2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol
SMILESCN1CCOC(c2ncc(CO)s2)C1
InChIInChI=1S/C9H14N2O2S/c1-11-2-3-13-8(5-11)9-10-4-7(6-12)14-9/h4,8,12H,2-3,5-6H2,1H3
InChIKeyQCIAGFNECTVGES-UHFFFAOYSA-N
XLogP0.64
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol (CID 79086066) is [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol is CN1CCOC(c2ncc(CO)s2)C1.
What is the InChIKey of [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is QCIAGFNECTVGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-11-2-3-13-8(5-11)9-10-4-7(6-12)14-9/h4,8,12H,2-3,5-6H2,1H3.
What are the key properties of [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol?
[2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 214.29 g/mol, XLogP of 0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-methylmorpholin-2-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 79086066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).