2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol

C12H20N2O2S — CID 82515189

IUPAC2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol
SMILESCC(C)(O)c1csc(CCN2CCOCC2)n1
InChIInChI=1S/C12H20N2O2S/c1-12(2,15)10-9-17-11(13-10)3-4-14-5-7-16-8-6-14/h9,15H,3-8H2,1-2H3
InChIKeyNZDOIJVJDMMJPV-UHFFFAOYSA-N
MW256.37 g/mol
LogP1.25
Rot. Bonds4

About 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol

2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol (PubChem CID 82515189) has the molecular formula C12H20N2O2S and a molecular weight of 256.37 g/mol. Its IUPAC name is 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol.

Molecular Properties

Compound Name2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol
PubChem CID82515189
Molecular FormulaC12H20N2O2S
Molecular Weight256.37 g/mol
Exact Mass256.12
IUPAC Name2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol
SMILESCC(C)(O)c1csc(CCN2CCOCC2)n1
InChIInChI=1S/C12H20N2O2S/c1-12(2,15)10-9-17-11(13-10)3-4-14-5-7-16-8-6-14/h9,15H,3-8H2,1-2H3
InChIKeyNZDOIJVJDMMJPV-UHFFFAOYSA-N
XLogP1.25
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-4-yl]propan-2-ol
CID 82515336
2-[2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-4-yl]propan-2-ol
CID 82515229
2-[2-(2-pyrrolidin-1-ylethyl)-1,3-thiazol-4-yl]propan-2-amine
CID 82515335
2-[2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-thiazol-4-yl]propan-2-amine
CID 82515228
2-(2-morpholin-4-ylethyl)-1,3-thiazole-4-carbothioamide
CID 82515196
2-(2-morpholin-4-ylethyl)-1,3-thiazole-4-carboxamide
CID 141208836
1-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-amine
CID 115089637
1-[2-(4-tert-butyl-1,3-thiazol-2-yl)ethyl]-3-ethyl-2-(3-morpholin-4-ylpropyl)guanidine;hydroiodide
CID 111547824
4-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]aniline
CID 82098071
2-methyl-1-(4-morpholin-4-ylbutyl)-3-[2-[4-(trifluoromethyl)-1,3-thiazol-2-yl]ethyl]guanidine;hydroiodide
CID 111689635
[4-(2-morpholin-4-ylethyl)piperazin-1-yl]-(2-propyl-1,3-thiazol-4-yl)methanone
CID 77085528
2-[4-methyl-2-(2-morpholin-4-ylethyl)-1,3-thiazol-5-yl]propan-2-amine
CID 82427748

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol?
The IUPAC name of 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol (CID 82515189) is 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol.
What is the SMILES notation for 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol?
The canonical SMILES for 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol is CC(C)(O)c1csc(CCN2CCOCC2)n1.
What is the InChIKey of 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol?
The InChIKey is NZDOIJVJDMMJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S/c1-12(2,15)10-9-17-11(13-10)3-4-14-5-7-16-8-6-14/h9,15H,3-8H2,1-2H3.
What are the key properties of 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol?
2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol has a molecular weight of 256.37 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-morpholin-4-ylethyl)-1,3-thiazol-4-yl]propan-2-ol is sourced from PubChem (CID 82515189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).