N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide

C10H18F3NO2 — CID 79204331

IUPACN-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide
SMILESCCCCN(CC(F)(F)F)C(=O)CCCO
InChIInChI=1S/C10H18F3NO2/c1-2-3-6-14(8-10(11,12)13)9(16)5-4-7-15/h15H,2-8H2,1H3
InChIKeyCUQXTMSNSKGELP-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.95
Rot. Bonds7

About N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide

N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide (PubChem CID 79204331) has the molecular formula C10H18F3NO2 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide.

Molecular Properties

Compound NameN-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide
PubChem CID79204331
Molecular FormulaC10H18F3NO2
Molecular Weight241.25 g/mol
Exact Mass241.13
IUPAC NameN-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide
SMILESCCCCN(CC(F)(F)F)C(=O)CCCO
InChIInChI=1S/C10H18F3NO2/c1-2-3-6-14(8-10(11,12)13)9(16)5-4-7-15/h15H,2-8H2,1H3
InChIKeyCUQXTMSNSKGELP-UHFFFAOYSA-N
XLogP1.95
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)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

4-(N-Methyl-trifluoroacetamido)-1-butanol
CID 10512190
N-(2-fluorocyclopropyl)-4-hydroxy-N-propylbutanamide
CID 58375868
N-(3-fluorobutan-2-yl)-4-hydroxy-N-propylbutanamide
CID 87922265
2,2,2-trifluoro-N-(1-hydroxybutyl)-N-methylacetamide
CID 88174553
(2S)-2-fluoro-4-hydroxy-N,N-dimethylbutanamide
CID 171543133
(2R)-2-fluoro-4-hydroxy-N,N-dimethylbutanamide
CID 171543379
2,2,2-trifluoro-N-hexyl-N-(4-hydroxybutyl)acetamide
CID 44521286
N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)butanamide
CID 64590916
N-ethyl-4,4,4-trifluoro-N-(2-hydroxyethyl)butanamide
CID 65710972
4,4,4-trifluoro-N-(3-hydroxypropyl)-N-propan-2-ylbutanamide
CID 65710976
4,4,4-trifluoro-N-(2-hydroxyethyl)-N-propylbutanamide
CID 65711161
N-butyl-4,4,4-trifluoro-N-(2-hydroxyethyl)butanamide
CID 65711162

Frequently Asked Questions

What is the IUPAC name of N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide?
The IUPAC name of N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide (CID 79204331) is N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide.
What is the SMILES notation for N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide?
The canonical SMILES for N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide is CCCCN(CC(F)(F)F)C(=O)CCCO.
What is the InChIKey of N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide?
The InChIKey is CUQXTMSNSKGELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3NO2/c1-2-3-6-14(8-10(11,12)13)9(16)5-4-7-15/h15H,2-8H2,1H3.
What are the key properties of N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide?
N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide has a molecular weight of 241.25 g/mol, XLogP of 1.95, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-4-hydroxy-N-(2,2,2-trifluoroethyl)butanamide is sourced from PubChem (CID 79204331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).