N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide

C9H16F3NO2 — CID 64591107

IUPACN-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)(C)C(=O)N(CCO)CC(F)(F)F
InChIInChI=1S/C9H16F3NO2/c1-8(2,3)7(15)13(4-5-14)6-9(10,11)12/h14H,4-6H2,1-3H3
InChIKeyAQDFIMBMTFWVJX-UHFFFAOYSA-N
MW227.23 g/mol
LogP1.42
Rot. Bonds3

About N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide

N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 64591107) has the molecular formula C9H16F3NO2 and a molecular weight of 227.23 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID64591107
Molecular FormulaC9H16F3NO2
Molecular Weight227.23 g/mol
Exact Mass227.11
IUPAC NameN-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide
SMILESCC(C)(C)C(=O)N(CCO)CC(F)(F)F
InChIInChI=1S/C9H16F3NO2/c1-8(2,3)7(15)13(4-5-14)6-9(10,11)12/h14H,4-6H2,1-3H3
InChIKeyAQDFIMBMTFWVJX-UHFFFAOYSA-N
XLogP1.42
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide (CID 64591107) is N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide is CC(C)(C)C(=O)N(CCO)CC(F)(F)F.
What is the InChIKey of N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is AQDFIMBMTFWVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3NO2/c1-8(2,3)7(15)13(4-5-14)6-9(10,11)12/h14H,4-6H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide?
N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 227.23 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 64591107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).