N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide

C16H14F3NO3 — CID 46484833

IUPACN-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
SMILESCOc1ccc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1
InChIInChI=1S/C16H14F3NO3/c1-22-13-8-4-12(5-9-13)20-15(21)10-11-2-6-14(7-3-11)23-16(17,18)19/h2-9H,10H2,1H3,(H,20,21)
InChIKeyYVFNAKIIZXMVFU-UHFFFAOYSA-N
MW325.29 g/mol
LogP3.78
Rot. Bonds5

About N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide

N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide (PubChem CID 46484833) has the molecular formula C16H14F3NO3 and a molecular weight of 325.29 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
PubChem CID46484833
Molecular FormulaC16H14F3NO3
Molecular Weight325.29 g/mol
Exact Mass325.09
IUPAC NameN-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
SMILESCOc1ccc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1
InChIInChI=1S/C16H14F3NO3/c1-22-13-8-4-12(5-9-13)20-15(21)10-11-2-6-14(7-3-11)23-16(17,18)19/h2-9H,10H2,1H3,(H,20,21)
InChIKeyYVFNAKIIZXMVFU-UHFFFAOYSA-N
XLogP3.78
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.29
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2678277
2-(4-methoxyphenoxy)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2711310
2-(2,4-dimethoxyphenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 9404556
2-naphthalen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 18277342
2-methyl-3-[4-[[2-[4-(trifluoromethoxy)phenyl]acetyl]amino]phenyl]propanoic acid
CID 120540878
N-[4-(sulfamoylmethyl)phenyl]-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 60541692
2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 9129907
1-[2-(4-methoxyphenyl)ethyl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 55696660
4-methoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 2678249
N-[4-[[2-(4-methoxyphenyl)acetyl]amino]phenyl]butanamide
CID 17202461
2-(2,3,4,5,6-pentafluorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 5010640
N-[4-(2-aminoethyl)phenyl]-2-(4-methoxyphenyl)acetamide
CID 28754535

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide (CID 46484833) is N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide is COc1ccc(NC(=O)Cc2ccc(OC(F)(F)F)cc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is YVFNAKIIZXMVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F3NO3/c1-22-13-8-4-12(5-9-13)20-15(21)10-11-2-6-14(7-3-11)23-16(17,18)19/h2-9H,10H2,1H3,(H,20,21).
What are the key properties of N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide?
N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 325.29 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-2-[4-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 46484833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).