2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide

C9H14FN3O2 — CID 71019096

IUPAC2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide
SMILESCCc1c(CC(N)=O)[nH]c(=O)n1CCF
InChIInChI=1S/C9H14FN3O2/c1-2-7-6(5-8(11)14)12-9(15)13(7)4-3-10/h2-5H2,1H3,(H2,11,14)(H,12,15)
InChIKeyFXDZPVODZKYOED-UHFFFAOYSA-N
MW215.23 g/mol
LogP-0.26
Rot. Bonds5

About 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide

2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide (PubChem CID 71019096) has the molecular formula C9H14FN3O2 and a molecular weight of 215.23 g/mol. Its IUPAC name is 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide.

Molecular Properties

Compound Name2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide
PubChem CID71019096
Molecular FormulaC9H14FN3O2
Molecular Weight215.23 g/mol
Exact Mass215.11
IUPAC Name2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide
SMILESCCc1c(CC(N)=O)[nH]c(=O)n1CCF
InChIInChI=1S/C9H14FN3O2/c1-2-7-6(5-8(11)14)12-9(15)13(7)4-3-10/h2-5H2,1H3,(H2,11,14)(H,12,15)
InChIKeyFXDZPVODZKYOED-UHFFFAOYSA-N
XLogP-0.26
TPSA80.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.23
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-methyl-2-oxo-3-(3,3,3-trifluoropropyl)-1H-imidazol-5-yl]propanamide
CID 71019091
2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]butanamide
CID 71019106
(2S)-2-[6-methyl-2-oxo-3-(2,2,2-trifluoroethyl)-4,5-dihydro-1H-1,3-diazepin-7-yl]propanamide
CID 71019151
2-[4-ethyl-3-(2-fluoroethyl)-2-sulfanylidene-1H-imidazol-5-yl]acetamide
CID 71019228
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(2,2,2-trifluoroethyl)propanamide
CID 112527706
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(3,3,3-trifluoropropyl)propanamide
CID 112527773
4,5-diethyl-3-(2-fluoroethyl)-1H-imidazol-2-one
CID 143790256
2-[4-(2-aminoethyl)-3-(3-methylbutyl)-2-oxo-1H-imidazol-5-yl]acetamide
CID 71019094
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-ethylpropanamide
CID 84469950
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N,N-diethylpropanamide
CID 84472187
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-propylpropanamide
CID 84577589
N-butyl-3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-propylpropanamide
CID 108471914

Frequently Asked Questions

What is the IUPAC name of 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide?
The IUPAC name of 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide (CID 71019096) is 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide.
What is the SMILES notation for 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide?
The canonical SMILES for 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide is CCc1c(CC(N)=O)[nH]c(=O)n1CCF.
What is the InChIKey of 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide?
The InChIKey is FXDZPVODZKYOED-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14FN3O2/c1-2-7-6(5-8(11)14)12-9(15)13(7)4-3-10/h2-5H2,1H3,(H2,11,14)(H,12,15).
What are the key properties of 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide?
2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide has a molecular weight of 215.23 g/mol, XLogP of -0.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-ethyl-3-(2-fluoroethyl)-2-oxo-1H-imidazol-5-yl]acetamide is sourced from PubChem (CID 71019096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).