N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide

C17H21FN4O2 — CID 71991374

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide
SMILESCCc1cc(NC(=O)C(c2cccc(F)c2)N2CCOCC2)n[nH]1
InChIInChI=1S/C17H21FN4O2/c1-2-14-11-15(21-20-14)19-17(23)16(22-6-8-24-9-7-22)12-4-3-5-13(18)10-12/h3-5,10-11,16H,2,6-9H2,1H3,(H2,19,20,21,23)
InChIKeyAVGCTTIMJXVLES-UHFFFAOYSA-N
MW332.38 g/mol
LogP2.12
Rot. Bonds5

About N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide

N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide (PubChem CID 71991374) has the molecular formula C17H21FN4O2 and a molecular weight of 332.38 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide
PubChem CID71991374
Molecular FormulaC17H21FN4O2
Molecular Weight332.38 g/mol
Exact Mass332.16
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide
SMILESCCc1cc(NC(=O)C(c2cccc(F)c2)N2CCOCC2)n[nH]1
InChIInChI=1S/C17H21FN4O2/c1-2-14-11-15(21-20-14)19-17(23)16(22-6-8-24-9-7-22)12-4-3-5-13(18)10-12/h3-5,10-11,16H,2,6-9H2,1H3,(H2,19,20,21,23)
InChIKeyAVGCTTIMJXVLES-UHFFFAOYSA-N
XLogP2.12
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.38
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide 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-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide (CID 71991374) is N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide is CCc1cc(NC(=O)C(c2cccc(F)c2)N2CCOCC2)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide?
The InChIKey is AVGCTTIMJXVLES-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN4O2/c1-2-14-11-15(21-20-14)19-17(23)16(22-6-8-24-9-7-22)12-4-3-5-13(18)10-12/h3-5,10-11,16H,2,6-9H2,1H3,(H2,19,20,21,23).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide?
N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide has a molecular weight of 332.38 g/mol, XLogP of 2.12, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-fluorophenyl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 71991374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).