2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide

C18H18F3N3O — CID 70797932

IUPAC2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide
SMILESO=C(Cc1ccccn1)NC1CCCN1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C18H18F3N3O/c19-18(20,21)13-6-8-15(9-7-13)24-11-3-5-16(24)23-17(25)12-14-4-1-2-10-22-14/h1-2,4,6-10,16H,3,5,11-12H2,(H,23,25)
InChIKeyAJXWFTBUKBHMRB-UHFFFAOYSA-N
MW349.36 g/mol
LogP3.39
Rot. Bonds4

About 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide

2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide (PubChem CID 70797932) has the molecular formula C18H18F3N3O and a molecular weight of 349.36 g/mol. Its IUPAC name is 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide.

Molecular Properties

Compound Name2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide
PubChem CID70797932
Molecular FormulaC18H18F3N3O
Molecular Weight349.36 g/mol
Exact Mass349.14
IUPAC Name2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide
SMILESO=C(Cc1ccccn1)NC1CCCN1c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C18H18F3N3O/c19-18(20,21)13-6-8-15(9-7-13)24-11-3-5-16(24)23-17(25)12-14-4-1-2-10-22-14/h1-2,4,6-10,16H,3,5,11-12H2,(H,23,25)
InChIKeyAJXWFTBUKBHMRB-UHFFFAOYSA-N
XLogP3.39
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-pyridin-2-yl-N-[(3R)-1-[4-(trifluoromethyl)phenyl]piperidin-3-yl]acetamide
CID 58834511
1-[(2R)-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]-2-[5-(trifluoromethyl)-2-pyridinyl]ethanone
CID 158966559
2-pyridin-2-yl-1-[(2S)-2-[6-[[4-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95818185
2-pyridin-2-yl-1-[(2R)-2-[6-[[4-(trifluoromethyl)phenyl]methyl]-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95818184
2-phenyl-N-[[(2S)-1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]methyl]acetamide;2,2,2-trifluoroacetaldehyde
CID 161121216
[3-(pyridin-2-ylmethoxy)piperidin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 91770782
1-[(2S)-1-(4-chlorophenyl)pyrrolidin-2-yl]-2-[5-(trifluoromethyl)-2-pyridinyl]ethanone
CID 158966557
2-pyridin-2-yl-N-[2-(trifluoromethyl)phenyl]acetamide
CID 110696997
N-[4-(2,2-dimethylpropyl)cyclohexyl]-2-pyridin-2-ylacetamide
CID 164971686
N-[2-[(2S,5R,6R)-6-(hydroxymethyl)-5-[[4-(trifluoromethyl)phenyl]carbamoylamino]oxan-2-yl]ethyl]-2-pyridin-2-ylacetamide
CID 54642292
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-2-pyridin-2-ylacetamide
CID 107845294
N-[4-methyl-7-[4-(trifluoromethyl)phenyl]-4,5,7,12-tetrazatricyclo[6.4.0.02,6]dodeca-1(8),2,5,9,11-pentaen-11-yl]-2-pyridin-2-ylacetamide
CID 157037222

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide?
The IUPAC name of 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide (CID 70797932) is 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide.
What is the SMILES notation for 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide?
The canonical SMILES for 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide is O=C(Cc1ccccn1)NC1CCCN1c1ccc(C(F)(F)F)cc1.
What is the InChIKey of 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide?
The InChIKey is AJXWFTBUKBHMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3N3O/c19-18(20,21)13-6-8-15(9-7-13)24-11-3-5-16(24)23-17(25)12-14-4-1-2-10-22-14/h1-2,4,6-10,16H,3,5,11-12H2,(H,23,25).
What are the key properties of 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide?
2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide has a molecular weight of 349.36 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-N-[1-[4-(trifluoromethyl)phenyl]pyrrolidin-2-yl]acetamide is sourced from PubChem (CID 70797932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).