N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide

C20H15F3N2O4 — CID 2728304

IUPACN-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
InChIInChI=1S/C20H15F3N2O4/c1-27-14-8-10-15(11-9-14)28-19-17(3-2-12-24-19)25-18(26)13-4-6-16(7-5-13)29-20(21,22)23/h2-12H,1H3,(H,25,26)
InChIKeyLRPIYOZOARAGGL-UHFFFAOYSA-N
MW404.34 g/mol
LogP5.03
Rot. Bonds6

About N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide

N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide (PubChem CID 2728304) has the molecular formula C20H15F3N2O4 and a molecular weight of 404.34 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
PubChem CID2728304
Molecular FormulaC20H15F3N2O4
Molecular Weight404.34 g/mol
Exact Mass404.10
IUPAC NameN-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)c2ccc(OC(F)(F)F)cc2)cc1
InChIInChI=1S/C20H15F3N2O4/c1-27-14-8-10-15(11-9-14)28-19-17(3-2-12-24-19)25-18(26)13-4-6-16(7-5-13)29-20(21,22)23/h2-12H,1H3,(H,25,26)
InChIKeyLRPIYOZOARAGGL-UHFFFAOYSA-N
XLogP5.03
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.34
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(4-methoxyphenoxy)-3-pyridinyl]acetamide
CID 154411578
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(1,2,4-triazol-1-ylmethyl)benzamide
CID 55763737
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 55663053
4-(azepan-1-ylsulfonyl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide
CID 55661532
4-methoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 2678249
2-bromo-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide
CID 55764139
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 55763297
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 55873301
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide
CID 55661317
4-fluoro-N-[2-(4-methoxyphenoxy)-3-pyridinyl]-3-pyrrolidin-1-ylsulfonylbenzamide
CID 55763825
N-(2-methoxyphenyl)-4-[[4-(trifluoromethoxy)benzoyl]amino]benzamide
CID 26522670
3-(diethylsulfamoyl)-4-methoxy-N-[2-(4-methoxyphenoxy)-3-pyridinyl]benzamide
CID 55663083

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide (CID 2728304) is N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide is COc1ccc(Oc2ncccc2NC(=O)c2ccc(OC(F)(F)F)cc2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
The InChIKey is LRPIYOZOARAGGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F3N2O4/c1-27-14-8-10-15(11-9-14)28-19-17(3-2-12-24-19)25-18(26)13-4-6-16(7-5-13)29-20(21,22)23/h2-12H,1H3,(H,25,26).
What are the key properties of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide?
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide has a molecular weight of 404.34 g/mol, XLogP of 5.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenoxy)-3-pyridinyl]-4-(trifluoromethoxy)benzamide is sourced from PubChem (CID 2728304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).