N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide

C18H18F3N3O2 — CID 74622794

IUPACN-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESO=C(COc1ccccc1C(F)(F)F)Nc1cccc(C2CCNN2)c1
InChIInChI=1S/C18H18F3N3O2/c19-18(20,21)14-6-1-2-7-16(14)26-11-17(25)23-13-5-3-4-12(10-13)15-8-9-22-24-15/h1-7,10,15,22,24H,8-9,11H2,(H,23,25)
InChIKeyZRSRYNHRMHNHPY-UHFFFAOYSA-N
MW365.36 g/mol
LogP3.26
Rot. Bonds5

About N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide

N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide (PubChem CID 74622794) has the molecular formula C18H18F3N3O2 and a molecular weight of 365.36 g/mol. Its IUPAC name is N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
PubChem CID74622794
Molecular FormulaC18H18F3N3O2
Molecular Weight365.36 g/mol
Exact Mass365.14
IUPAC NameN-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
SMILESO=C(COc1ccccc1C(F)(F)F)Nc1cccc(C2CCNN2)c1
InChIInChI=1S/C18H18F3N3O2/c19-18(20,21)14-6-1-2-7-16(14)26-11-17(25)23-13-5-3-4-12(10-13)15-8-9-22-24-15/h1-7,10,15,22,24H,8-9,11H2,(H,23,25)
InChIKeyZRSRYNHRMHNHPY-UHFFFAOYSA-N
XLogP3.26
TPSA62.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.36
LogP ≤ 53.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(cyclohexylsulfinylmethyl)phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 86963463
N-(4-hydroxyphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 164545151
N-[3-(1,1-dioxo-1,4-thiazinan-4-yl)phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 86833830
N-pyridin-3-yl-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 75414453
2-(2-chlorophenoxy)-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide
CID 19171328
N-[3-(5-oxopyrrolidin-2-yl)phenyl]-2-phenoxyacetamide
CID 167939156
N-[2,6-di(propan-2-yl)phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39088271
N-[3-(1-methyltetrazol-5-yl)phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 46686823
N-(2,5-difluorophenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 39088986
N-[3-[[2-(2-tert-butylphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 17189278
N-[2-[(dimethylamino)methyl]phenyl]-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 38435524
N,N-diethyl-4-[[2-[2-(trifluoromethyl)phenoxy]acetyl]amino]benzamide
CID 46686486

Frequently Asked Questions

What is the IUPAC name of N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
The IUPAC name of N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide (CID 74622794) is N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide.
What is the SMILES notation for N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
The canonical SMILES for N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide is O=C(COc1ccccc1C(F)(F)F)Nc1cccc(C2CCNN2)c1.
What is the InChIKey of N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
The InChIKey is ZRSRYNHRMHNHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3N3O2/c19-18(20,21)14-6-1-2-7-16(14)26-11-17(25)23-13-5-3-4-12(10-13)15-8-9-22-24-15/h1-7,10,15,22,24H,8-9,11H2,(H,23,25).
What are the key properties of N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide?
N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide has a molecular weight of 365.36 g/mol, XLogP of 3.26, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrazolidin-3-ylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide is sourced from PubChem (CID 74622794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).