N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide

C18H13F3N2O2S — CID 173291686

IUPACN-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide
SMILESCNC(=O)c1ccc(-c2cccc(Oc3csc(C(F)(F)F)c3)n2)cc1
InChIInChI=1S/C18H13F3N2O2S/c1-22-17(24)12-7-5-11(6-8-12)14-3-2-4-16(23-14)25-13-9-15(26-10-13)18(19,20)21/h2-10H,1H3,(H,22,24)
InChIKeyRFXSYFXBWBLZOO-UHFFFAOYSA-N
MW378.38 g/mol
LogP4.98
Rot. Bonds4

About N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide

N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide (PubChem CID 173291686) has the molecular formula C18H13F3N2O2S and a molecular weight of 378.38 g/mol. Its IUPAC name is N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide
PubChem CID173291686
Molecular FormulaC18H13F3N2O2S
Molecular Weight378.38 g/mol
Exact Mass378.06
IUPAC NameN-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide
SMILESCNC(=O)c1ccc(-c2cccc(Oc3csc(C(F)(F)F)c3)n2)cc1
InChIInChI=1S/C18H13F3N2O2S/c1-22-17(24)12-7-5-11(6-8-12)14-3-2-4-16(23-14)25-13-9-15(26-10-13)18(19,20)21/h2-10H,1H3,(H,22,24)
InChIKeyRFXSYFXBWBLZOO-UHFFFAOYSA-N
XLogP4.98
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.38
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluorophenyl)-6-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine-2-carboxamide
CID 11222778
4-chloro-2-[4-(trifluoromethyl)phenyl]-6-[5-(trifluoromethyl)thiophen-3-yl]oxypyrimidine
CID 15477079
4-propyl-2-[4-(trifluoromethyl)phenyl]-6-[5-(trifluoromethyl)thiophen-3-yl]oxypyrimidine
CID 15477077
2-phenoxy-6-[4-(trifluoromethyl)phenyl]pyridine
CID 102190448
N-methyl-4-(4-phenyl-1,3-thiazol-2-yl)benzamide
CID 1483692
N-methyl-4-[4-(trifluoromethyl)phenoxy]benzamide
CID 146305988
N-methyl-3-(2-methyl-1,3-thiazol-4-yl)benzamide
CID 70899033
N-methyl-4-pyridin-2-ylbenzamide
CID 110464841
methyl 4-[4-(6-methoxy-2-pyridinyl)phenyl]benzoate
CID 171697651
4-methyl-2-[6-[3-(trifluoromethyl)phenoxy]-2-pyridinyl]-1,3-thiazole
CID 18921392
N-[6-(6-phenoxy-2-pyridinyl)-1,3-benzothiazol-2-yl]acetamide
CID 143757565
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-4-(trifluoromethoxy)benzamide
CID 8534106

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide?
The IUPAC name of N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide (CID 173291686) is N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide.
What is the SMILES notation for N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide?
The canonical SMILES for N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide is CNC(=O)c1ccc(-c2cccc(Oc3csc(C(F)(F)F)c3)n2)cc1.
What is the InChIKey of N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide?
The InChIKey is RFXSYFXBWBLZOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N2O2S/c1-22-17(24)12-7-5-11(6-8-12)14-3-2-4-16(23-14)25-13-9-15(26-10-13)18(19,20)21/h2-10H,1H3,(H,22,24).
What are the key properties of N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide?
N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide has a molecular weight of 378.38 g/mol, XLogP of 4.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[6-[5-(trifluoromethyl)thiophen-3-yl]oxy-2-pyridinyl]benzamide is sourced from PubChem (CID 173291686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).