2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide

C16H13ClF3NO2 — CID 15907736

IUPAC2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C16H13ClF3NO2/c1-23-14-7-4-12(17)8-10(14)9-15(22)21-13-5-2-11(3-6-13)16(18,19)20/h2-8H,9H2,1H3,(H,21,22)
InChIKeyKIAZQQNFKBFOFX-UHFFFAOYSA-N
MW343.73 g/mol
LogP4.55
Rot. Bonds4

About 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide

2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 15907736) has the molecular formula C16H13ClF3NO2 and a molecular weight of 343.73 g/mol. Its IUPAC name is 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID15907736
Molecular FormulaC16H13ClF3NO2
Molecular Weight343.73 g/mol
Exact Mass343.06
IUPAC Name2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
SMILESCOc1ccc(Cl)cc1CC(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C16H13ClF3NO2/c1-23-14-7-4-12(17)8-10(14)9-15(22)21-13-5-2-11(3-6-13)16(18,19)20/h2-8H,9H2,1H3,(H,21,22)
InChIKeyKIAZQQNFKBFOFX-UHFFFAOYSA-N
XLogP4.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.73
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-(3-chloro-4-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]propanediamide
CID 108955403
N-(4-chlorophenyl)-2-(2,5-dimethoxyphenyl)acetamide
CID 78804409
[2-(4-methoxyanilino)-2-oxoethyl] 2-(5-chloro-2-methoxyphenyl)acetate
CID 8615173
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-(2,5-dimethoxyphenyl)acetamide
CID 92670451
tert-butyl N-[3-[[2-(5-chloro-2-methoxyphenyl)acetyl]amino]-4-fluorophenyl]carbamate
CID 78861114
2-[5-[(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-2-methoxyphenyl]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 86759439
N-(3-chloro-4-methoxyphenyl)-2-[3-(trifluoromethyl)phenyl]acetamide
CID 7934876
2-(5-chloro-2-methoxyphenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 17423898
1-(5-chloro-2-methoxyphenyl)-4,4,4-trifluorobutan-2-one
CID 62620064
N-(4-chlorophenyl)-2-(4-methoxy-3-methylphenyl)acetamide
CID 16848482
2-(2-amino-4,5-dimethoxyphenyl)-N-(4-chlorophenyl)acetamide
CID 99987219
N-(4-tert-butylphenyl)-2-(2,4-dichlorophenyl)acetamide
CID 7914224

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide (CID 15907736) is 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide is COc1ccc(Cl)cc1CC(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is KIAZQQNFKBFOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClF3NO2/c1-23-14-7-4-12(17)8-10(14)9-15(22)21-13-5-2-11(3-6-13)16(18,19)20/h2-8H,9H2,1H3,(H,21,22).
What are the key properties of 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide?
2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 343.73 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 15907736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).