N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide

C21H22F3NO2 — CID 52845959

IUPACN-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCOc1ccc(C2(NC(=O)Cc3ccc(C(F)(F)F)cc3)CCCC2)cc1
InChIInChI=1S/C21H22F3NO2/c1-27-18-10-8-16(9-11-18)20(12-2-3-13-20)25-19(26)14-15-4-6-17(7-5-15)21(22,23)24/h4-11H,2-3,12-14H2,1H3,(H,25,26)
InChIKeyKGGMESVATMLTFO-UHFFFAOYSA-N
MW377.41 g/mol
LogP4.84
Rot. Bonds5

About N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide

N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 52845959) has the molecular formula C21H22F3NO2 and a molecular weight of 377.41 g/mol. Its IUPAC name is N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID52845959
Molecular FormulaC21H22F3NO2
Molecular Weight377.41 g/mol
Exact Mass377.16
IUPAC NameN-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCOc1ccc(C2(NC(=O)Cc3ccc(C(F)(F)F)cc3)CCCC2)cc1
InChIInChI=1S/C21H22F3NO2/c1-27-18-10-8-16(9-11-18)20(12-2-3-13-20)25-19(26)14-15-4-6-17(7-5-15)21(22,23)24/h4-11H,2-3,12-14H2,1H3,(H,25,26)
InChIKeyKGGMESVATMLTFO-UHFFFAOYSA-N
XLogP4.84
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.41
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-fluorophenyl)cyclopentyl]-2-(4-methoxyphenyl)acetamide
CID 110440158
N-[1-(4-methoxyphenyl)cyclobutyl]-3-oxobutanamide
CID 110477390
3-amino-N-[1-(4-methoxyphenyl)cyclohexyl]propanamide
CID 110478988
4-amino-N-[1-(4-methoxyphenyl)cyclopentyl]butanamide
CID 119309997
N-[1-(4-methoxyphenyl)cyclopropyl]propanamide
CID 113091106
N-[1-(4-methoxyphenyl)cyclohexyl]-2-methylpropanamide
CID 110478522
N-(1-cyanocyclopentyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 60704808
N-[[1-(methoxymethyl)cyclopentyl]methyl]-2-[4-(trifluoromethyl)phenyl]acetamide
CID 91776931
2-(4-aminophenyl)-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide
CID 119806400
4-(4-methoxyphenyl)-N-[[4-(trifluoromethyl)phenyl]methyl]oxane-4-carboxamide
CID 47720644
N-[[1-(4-methoxyphenyl)cyclopropyl]methyl]-4-(trifluoromethyl)benzamide
CID 42265583
N-[1-(hydroxymethyl)cyclopropyl]-2-(4-methoxyphenyl)acetamide
CID 113337518

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide (CID 52845959) is N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide is COc1ccc(C2(NC(=O)Cc3ccc(C(F)(F)F)cc3)CCCC2)cc1.
What is the InChIKey of N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is KGGMESVATMLTFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22F3NO2/c1-27-18-10-8-16(9-11-18)20(12-2-3-13-20)25-19(26)14-15-4-6-17(7-5-15)21(22,23)24/h4-11H,2-3,12-14H2,1H3,(H,25,26).
What are the key properties of N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide?
N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 377.41 g/mol, XLogP of 4.84, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxyphenyl)cyclopentyl]-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 52845959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).