N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide

C14H15F3N2O2 — CID 139993358

IUPACN-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCCC2)c(C(F)(F)F)c1
InChIInChI=1S/C14H15F3N2O2/c1-9(20)18-10-4-5-11(12(8-10)14(15,16)17)13(21)19-6-2-3-7-19/h4-5,8H,2-3,6-7H2,1H3,(H,18,20)
InChIKeyZYWCJLZRNPWAQE-UHFFFAOYSA-N
MW300.28 g/mol
LogP2.90
Rot. Bonds2

About N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide

N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide (PubChem CID 139993358) has the molecular formula C14H15F3N2O2 and a molecular weight of 300.28 g/mol. Its IUPAC name is N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide
PubChem CID139993358
Molecular FormulaC14H15F3N2O2
Molecular Weight300.28 g/mol
Exact Mass300.11
IUPAC NameN-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide
SMILESCC(=O)Nc1ccc(C(=O)N2CCCC2)c(C(F)(F)F)c1
InChIInChI=1S/C14H15F3N2O2/c1-9(20)18-10-4-5-11(12(8-10)14(15,16)17)13(21)19-6-2-3-7-19/h4-5,8H,2-3,6-7H2,1H3,(H,18,20)
InChIKeyZYWCJLZRNPWAQE-UHFFFAOYSA-N
XLogP2.90
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.28
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]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

N-[4-fluoro-3-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 47456948
dimethyl (E)-2-[4-(4-methylpiperazine-1-carbonyl)-3-(trifluoromethyl)anilino]but-2-enedioate
CID 168569868
N-[4-amino-3-(trifluoromethyl)phenyl]pyrrolidine-1-carboxamide
CID 79161006
1-(5-acetamido-2-fluorobenzoyl)piperidine-4-carboxylic acid
CID 119349532
N-[3-(1,4-diazepane-1-carbonyl)-4-fluorophenyl]acetamide
CID 119414587
N-[4-acetamido-2-(trifluoromethyl)phenyl]-4-(2,2,2-trifluoroethyl)-1,4-diazepane-1-carboxamide
CID 112825354
N-[4-chloro-3-(trifluoromethyl)phenyl]-2,2-dimethyl-3-oxo-3-piperidin-1-ylpropanamide
CID 108958892
1-[3-(pyrrolidine-1-carbonyl)-4-pyrrolidin-1-ylphenyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 42660816
N-[4-(aminomethyl)-3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 79156712
1-[3-(piperidine-1-carbonyl)-4-pyrrolidin-1-ylphenyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 1064185
N-[4-[4-[2-(trifluoromethyl)benzoyl]piperazine-1-carbonyl]phenyl]cyclopropanecarboxamide
CID 46415747
2-[3-fluoro-4-(pyrrolidine-1-carbonyl)anilino]ethene-1,1,2-tricarbonitrile
CID 168610084

Frequently Asked Questions

What is the IUPAC name of N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide (CID 139993358) is N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide is CC(=O)Nc1ccc(C(=O)N2CCCC2)c(C(F)(F)F)c1.
What is the InChIKey of N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide?
The InChIKey is ZYWCJLZRNPWAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F3N2O2/c1-9(20)18-10-4-5-11(12(8-10)14(15,16)17)13(21)19-6-2-3-7-19/h4-5,8H,2-3,6-7H2,1H3,(H,18,20).
What are the key properties of N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide?
N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide has a molecular weight of 300.28 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(pyrrolidine-1-carbonyl)-3-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 139993358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).