N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide

C10H12F3N3O2S — CID 165434395

IUPACN-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide
SMILESCNC(=O)C1CN(c2nc(C(F)(F)F)cs2)CCO1
InChIInChI=1S/C10H12F3N3O2S/c1-14-8(17)6-4-16(2-3-18-6)9-15-7(5-19-9)10(11,12)13/h5-6H,2-4H2,1H3,(H,14,17)
InChIKeyDLGNXNXWJHIDOO-UHFFFAOYSA-N
MW295.29 g/mol
LogP1.11
Rot. Bonds2

About N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide

N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide (PubChem CID 165434395) has the molecular formula C10H12F3N3O2S and a molecular weight of 295.29 g/mol. Its IUPAC name is N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide
PubChem CID165434395
Molecular FormulaC10H12F3N3O2S
Molecular Weight295.29 g/mol
Exact Mass295.06
IUPAC NameN-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide
SMILESCNC(=O)C1CN(c2nc(C(F)(F)F)cs2)CCO1
InChIInChI=1S/C10H12F3N3O2S/c1-14-8(17)6-4-16(2-3-18-6)9-15-7(5-19-9)10(11,12)13/h5-6H,2-4H2,1H3,(H,14,17)
InChIKeyDLGNXNXWJHIDOO-UHFFFAOYSA-N
XLogP1.11
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-[4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholin-2-yl]methanone
CID 172891941
N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidin-3-yl]acetamide
CID 171327941
4-methyl-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidin-3-ol
CID 133446751
4-(6-chloro-1,3-benzothiazol-2-yl)-N-methylmorpholine-2-carboxamide
CID 166602787
N-cyclopropyl-1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 163348930
2-N-methyl-4-N-(4-methyl-1,3-thiazol-2-yl)morpholine-2,4-dicarboxamide
CID 75484296
2-(3-methylpiperidin-1-yl)-4-(trifluoromethyl)-1,3-thiazole
CID 133365893
4-(5-methoxy-1,3-benzothiazol-2-yl)-N-methylmorpholine-2-carboxamide
CID 166602705
(2R)-N-methyl-4-(4-methylpyrimidin-2-yl)morpholine-2-carboxamide
CID 97348797
6-[4-(trifluoromethyl)-1,3-thiazol-2-yl]-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridine
CID 133383794
N-methyl-4-pyrazin-2-ylmorpholine-2-carboxamide
CID 110268192
N,2,2-trimethyl-N-[1-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidin-3-yl]propanamide
CID 163351231

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
The IUPAC name of N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide (CID 165434395) is N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide.
What is the SMILES notation for N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
The canonical SMILES for N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide is CNC(=O)C1CN(c2nc(C(F)(F)F)cs2)CCO1.
What is the InChIKey of N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
The InChIKey is DLGNXNXWJHIDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3N3O2S/c1-14-8(17)6-4-16(2-3-18-6)9-15-7(5-19-9)10(11,12)13/h5-6H,2-4H2,1H3,(H,14,17).
What are the key properties of N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide has a molecular weight of 295.29 g/mol, XLogP of 1.11, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[4-(trifluoromethyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide is sourced from PubChem (CID 165434395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).