2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide

C10H16FN3O3 — CID 71019103

IUPAC2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide
SMILESCOCC(C(N)=O)c1[nH]c(=O)n(CCF)c1C
InChIInChI=1S/C10H16FN3O3/c1-6-8(7(5-17-2)9(12)15)13-10(16)14(6)4-3-11/h7H,3-5H2,1-2H3,(H2,12,15)(H,13,16)
InChIKeyAQMIUJVQEVFXMF-UHFFFAOYSA-N
MW245.25 g/mol
LogP-0.33
Rot. Bonds6

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

2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide (PubChem CID 71019103) has the molecular formula C10H16FN3O3 and a molecular weight of 245.25 g/mol. Its IUPAC name is 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide.

Molecular Properties

Compound Name2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide
PubChem CID71019103
Molecular FormulaC10H16FN3O3
Molecular Weight245.25 g/mol
Exact Mass245.12
IUPAC Name2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide
SMILESCOCC(C(N)=O)c1[nH]c(=O)n(CCF)c1C
InChIInChI=1S/C10H16FN3O3/c1-6-8(7(5-17-2)9(12)15)13-10(16)14(6)4-3-11/h7H,3-5H2,1-2H3,(H2,12,15)(H,13,16)
InChIKeyAQMIUJVQEVFXMF-UHFFFAOYSA-N
XLogP-0.33
TPSA90.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.25
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide 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-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide?
The IUPAC name of 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide (CID 71019103) is 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide.
What is the SMILES notation for 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide?
The canonical SMILES for 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide is COCC(C(N)=O)c1[nH]c(=O)n(CCF)c1C.
What is the InChIKey of 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide?
The InChIKey is AQMIUJVQEVFXMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3O3/c1-6-8(7(5-17-2)9(12)15)13-10(16)14(6)4-3-11/h7H,3-5H2,1-2H3,(H2,12,15)(H,13,16).
What are the key properties of 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide?
2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide has a molecular weight of 245.25 g/mol, XLogP of -0.33, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-fluoroethyl)-4-methyl-2-oxo-1H-imidazol-5-yl]-3-methoxypropanamide is sourced from PubChem (CID 71019103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).