2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide

C16H14F3NO4 — CID 8621705

IUPAC2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
SMILESCOc1ccc(OC)c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1
InChIInChI=1S/C16H14F3NO4/c1-22-12-7-8-14(23-2)13(9-12)15(21)20-10-3-5-11(6-4-10)24-16(17,18)19/h3-9H,1-2H3,(H,20,21)
InChIKeyZPTGWLUVWDOFSB-UHFFFAOYSA-N
MW341.29 g/mol
LogP3.85
Rot. Bonds5

About 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide

2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide (PubChem CID 8621705) has the molecular formula C16H14F3NO4 and a molecular weight of 341.29 g/mol. Its IUPAC name is 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
PubChem CID8621705
Molecular FormulaC16H14F3NO4
Molecular Weight341.29 g/mol
Exact Mass341.09
IUPAC Name2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
SMILESCOc1ccc(OC)c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1
InChIInChI=1S/C16H14F3NO4/c1-22-12-7-8-14(23-2)13(9-12)15(21)20-10-3-5-11(6-4-10)24-16(17,18)19/h3-9H,1-2H3,(H,20,21)
InChIKeyZPTGWLUVWDOFSB-UHFFFAOYSA-N
XLogP3.85
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.29
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethoxy-N-(4-methoxyphenyl)benzamide
CID 8574615
N-(4-hydroxyphenyl)-2,5-dimethoxybenzamide
CID 48824493
2,3,4-trimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 7768109
2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 110761096
2,3-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 24641310
4-methoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 2678249
N-(3-bromo-4-fluorophenyl)-2,5-dimethoxybenzamide
CID 115661440
2-chloro-N-[4-[(5-chloro-2-methoxybenzoyl)amino]phenyl]-5-methoxybenzamide
CID 4077998
4-methoxy-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 71608233
2-(2,4-dimethoxyphenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 9404556
3,7-dichloro-6-methoxy-N-[4-(trifluoromethoxy)phenyl]-1-benzothiophene-2-carboxamide
CID 4830286
3-methoxy-4-[2-(4-methoxyanilino)-2-oxoethoxy]-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 16552258

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide?
The IUPAC name of 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide (CID 8621705) is 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide.
What is the SMILES notation for 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide?
The canonical SMILES for 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide is COc1ccc(OC)c(C(=O)Nc2ccc(OC(F)(F)F)cc2)c1.
What is the InChIKey of 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide?
The InChIKey is ZPTGWLUVWDOFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO4/c1-22-12-7-8-14(23-2)13(9-12)15(21)20-10-3-5-11(6-4-10)24-16(17,18)19/h3-9H,1-2H3,(H,20,21).
What are the key properties of 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide?
2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide has a molecular weight of 341.29 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide is sourced from PubChem (CID 8621705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).