morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone

C9H9F3N2O2S — CID 106784663

IUPACmorpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
SMILESO=C(c1cnc(C(F)(F)F)s1)C1CNCCO1
InChIInChI=1S/C9H9F3N2O2S/c10-9(11,12)8-14-4-6(17-8)7(15)5-3-13-1-2-16-5/h4-5,13H,1-3H2
InChIKeyLQRRWNNEZBNZID-UHFFFAOYSA-N
MW266.24 g/mol
LogP1.33
Rot. Bonds2

About morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone

morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone (PubChem CID 106784663) has the molecular formula C9H9F3N2O2S and a molecular weight of 266.24 g/mol. Its IUPAC name is morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone.

Molecular Properties

Compound Namemorpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
PubChem CID106784663
Molecular FormulaC9H9F3N2O2S
Molecular Weight266.24 g/mol
Exact Mass266.03
IUPAC Namemorpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
SMILESO=C(c1cnc(C(F)(F)F)s1)C1CNCCO1
InChIInChI=1S/C9H9F3N2O2S/c10-9(11,12)8-14-4-6(17-8)7(15)5-3-13-1-2-16-5/h4-5,13H,1-3H2
InChIKeyLQRRWNNEZBNZID-UHFFFAOYSA-N
XLogP1.33
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.24
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Ethoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]propan-1-one
CID 106782500
3,4,6,7,8,8a-hexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-3-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782573
2-Methoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]propan-1-one
CID 106782578
(4-Ethylmorpholin-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782579
(4-Propylmorpholin-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782580
(4-Propan-2-ylmorpholin-2-yl)-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782581
1,4-Oxathian-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone
CID 106782584
2-Methoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-one
CID 106782641
2-Ethoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-one
CID 106782642
2-Ethoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pentan-1-one
CID 106782643
2-Methoxy-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]pentan-1-one
CID 106782644
2-Ethoxy-3-methyl-1-[2-(trifluoromethyl)-1,3-thiazol-5-yl]butan-1-one
CID 106782646

Frequently Asked Questions

What is the IUPAC name of morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone?
The IUPAC name of morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone (CID 106784663) is morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone.
What is the SMILES notation for morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone?
The canonical SMILES for morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone is O=C(c1cnc(C(F)(F)F)s1)C1CNCCO1.
What is the InChIKey of morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone?
The InChIKey is LQRRWNNEZBNZID-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2O2S/c10-9(11,12)8-14-4-6(17-8)7(15)5-3-13-1-2-16-5/h4-5,13H,1-3H2.
What are the key properties of morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone?
morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone has a molecular weight of 266.24 g/mol, XLogP of 1.33, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-2-yl-[2-(trifluoromethyl)-1,3-thiazol-5-yl]methanone is sourced from PubChem (CID 106784663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).