2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide

C10H18F3N3O2 — CID 88741446

IUPAC2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
SMILESCC(NC(=O)C(F)(F)F)N1CCN(CCO)CC1
InChIInChI=1S/C10H18F3N3O2/c1-8(14-9(18)10(11,12)13)16-4-2-15(3-5-16)6-7-17/h8,17H,2-7H2,1H3,(H,14,18)
InChIKeyDLXHRFWEAKTNQJ-UHFFFAOYSA-N
MW269.27 g/mol
LogP-0.38
Rot. Bonds4

About 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide

2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide (PubChem CID 88741446) has the molecular formula C10H18F3N3O2 and a molecular weight of 269.27 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
PubChem CID88741446
Molecular FormulaC10H18F3N3O2
Molecular Weight269.27 g/mol
Exact Mass269.14
IUPAC Name2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide
SMILESCC(NC(=O)C(F)(F)F)N1CCN(CCO)CC1
InChIInChI=1S/C10H18F3N3O2/c1-8(14-9(18)10(11,12)13)16-4-2-15(3-5-16)6-7-17/h8,17H,2-7H2,1H3,(H,14,18)
InChIKeyDLXHRFWEAKTNQJ-UHFFFAOYSA-N
XLogP-0.38
TPSA55.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.27
LogP ≤ 5-0.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide 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 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
The IUPAC name of 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide (CID 88741446) is 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide is CC(NC(=O)C(F)(F)F)N1CCN(CCO)CC1.
What is the InChIKey of 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
The InChIKey is DLXHRFWEAKTNQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N3O2/c1-8(14-9(18)10(11,12)13)16-4-2-15(3-5-16)6-7-17/h8,17H,2-7H2,1H3,(H,14,18).
What are the key properties of 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide?
2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide has a molecular weight of 269.27 g/mol, XLogP of -0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-[1-[4-(2-hydroxyethyl)piperazin-1-yl]ethyl]acetamide is sourced from PubChem (CID 88741446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).