N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide

C10H18F3N3O — CID 55008632

IUPACN-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCN(CC(F)(F)F)C(=O)CN1CCNCC1
InChIInChI=1S/C10H18F3N3O/c1-2-16(8-10(11,12)13)9(17)7-15-5-3-14-4-6-15/h14H,2-8H2,1H3
InChIKeyJLYOWYBDUWEWEF-UHFFFAOYSA-N
MW253.27 g/mol
LogP0.30
Rot. Bonds4

About N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide

N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 55008632) has the molecular formula C10H18F3N3O and a molecular weight of 253.27 g/mol. Its IUPAC name is N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID55008632
Molecular FormulaC10H18F3N3O
Molecular Weight253.27 g/mol
Exact Mass253.14
IUPAC NameN-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCN(CC(F)(F)F)C(=O)CN1CCNCC1
InChIInChI=1S/C10H18F3N3O/c1-2-16(8-10(11,12)13)9(17)7-15-5-3-14-4-6-15/h14H,2-8H2,1H3
InChIKeyJLYOWYBDUWEWEF-UHFFFAOYSA-N
XLogP0.30
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.27
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-(piperazin-1-yl)acetamide
CID 2758642
N-isopropyl-1-piperazineacetamide
CID 100826
1-Methyl-3-oxopiperazine
CID 13704283
1-Methylpiperazin-2-one
CID 4399042
Trifluoroacetylpiperazine
CID 7172020
2-(Methylamino)-1-(4-methylpiperazin-1-yl)ethanone
CID 2574890
N-butyl-2-piperazin-1-yl-N-propylacetamide
CID 49853676
Oxamide, N-methyl-N'-[2-(4-piperazinyl)ethyl]-
CID 567248
N,N-diethyl-2-(piperazin-1-yl)acetamide
CID 7131630
1-Ethylpiperazin-2-one
CID 9877366
2-(Dimethylamino)-1-(piperazin-1-yl)ethan-1-one
CID 16770302
2-(Diethylamino)-1-(piperazin-1-yl)ethan-1-one
CID 16770303

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide (CID 55008632) is N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide is CCN(CC(F)(F)F)C(=O)CN1CCNCC1.
What is the InChIKey of N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is JLYOWYBDUWEWEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N3O/c1-2-16(8-10(11,12)13)9(17)7-15-5-3-14-4-6-15/h14H,2-8H2,1H3.
What are the key properties of N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide?
N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 253.27 g/mol, XLogP of 0.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-piperazin-1-yl-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 55008632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).