3-(2,4,6-trifluorophenyl)butanamide

C10H10F3NO — CID 164885056

IUPAC3-(2,4,6-trifluorophenyl)butanamide
SMILESCC(CC(N)=O)c1c(F)cc(F)cc1F
InChIInChI=1S/C10H10F3NO/c1-5(2-9(14)15)10-7(12)3-6(11)4-8(10)13/h3-5H,2H2,1H3,(H2,14,15)
InChIKeyUERQEGVAAPNAPL-UHFFFAOYSA-N
MW217.19 g/mol
LogP2.08
Rot. Bonds3

About 3-(2,4,6-trifluorophenyl)butanamide

3-(2,4,6-trifluorophenyl)butanamide (PubChem CID 164885056) has the molecular formula C10H10F3NO and a molecular weight of 217.19 g/mol. Its IUPAC name is 3-(2,4,6-trifluorophenyl)butanamide.

Molecular Properties

Compound Name3-(2,4,6-trifluorophenyl)butanamide
PubChem CID164885056
Molecular FormulaC10H10F3NO
Molecular Weight217.19 g/mol
Exact Mass217.07
IUPAC Name3-(2,4,6-trifluorophenyl)butanamide
SMILESCC(CC(N)=O)c1c(F)cc(F)cc1F
InChIInChI=1S/C10H10F3NO/c1-5(2-9(14)15)10-7(12)3-6(11)4-8(10)13/h3-5H,2H2,1H3,(H2,14,15)
InChIKeyUERQEGVAAPNAPL-UHFFFAOYSA-N
XLogP2.08
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.19
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2,4,6-trifluorophenyl)butanamide 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

3-(3,5-difluoro-2-pyridinyl)butanamide
CID 172777205
4-(2-bromo-4,6-difluorophenyl)-3,4-dihydroxybutanamide
CID 171900289
3-amino-3-(3-fluoro-5-methylphenyl)propanamide
CID 55255925
2-[(2,4,6-trifluorophenyl)sulfonylamino]acetamide
CID 64590449
3-(3,5-dimethyl-4-pyridinyl)butanamide
CID 173252399
3-(2,4-difluorophenyl)-3-hydroxypropanamide
CID 69415011
3-[3,5-bis(trifluoromethyl)phenyl]butanamide
CID 173252522
(3R)-3-[3,5-bis(trifluoromethyl)phenyl]butanamide
CID 87395828
3-amino-3-(3,4,5-trifluorophenyl)propanamide
CID 63052709
3-(3,5-dichlorophenyl)butanamide
CID 173252327
3-(2-fluoro-4,6-dimethylphenyl)butanoic acid
CID 84781229
2-methyl-1-(2,4,6-trifluorophenyl)propan-1-amine
CID 43198662

Frequently Asked Questions

What is the IUPAC name of 3-(2,4,6-trifluorophenyl)butanamide?
The IUPAC name of 3-(2,4,6-trifluorophenyl)butanamide (CID 164885056) is 3-(2,4,6-trifluorophenyl)butanamide.
What is the SMILES notation for 3-(2,4,6-trifluorophenyl)butanamide?
The canonical SMILES for 3-(2,4,6-trifluorophenyl)butanamide is CC(CC(N)=O)c1c(F)cc(F)cc1F.
What is the InChIKey of 3-(2,4,6-trifluorophenyl)butanamide?
The InChIKey is UERQEGVAAPNAPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO/c1-5(2-9(14)15)10-7(12)3-6(11)4-8(10)13/h3-5H,2H2,1H3,(H2,14,15).
What are the key properties of 3-(2,4,6-trifluorophenyl)butanamide?
3-(2,4,6-trifluorophenyl)butanamide has a molecular weight of 217.19 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4,6-trifluorophenyl)butanamide is sourced from PubChem (CID 164885056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).