2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

C16H18FN3O3 — CID 36737555

IUPAC2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCO[C@@H](c3ccc(F)cc3)C2)no1
InChIInChI=1S/C16H18FN3O3/c1-11-8-15(19-23-11)18-16(21)10-20-6-7-22-14(9-20)12-2-4-13(17)5-3-12/h2-5,8,14H,6-7,9-10H2,1H3,(H,18,19,21)/t14-/m1/s1
InChIKeyCCEUNYHHQAQISO-CQSZACIVSA-N
MW319.34 g/mol
LogP2.13
Rot. Bonds4

About 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide

2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (PubChem CID 36737555) has the molecular formula C16H18FN3O3 and a molecular weight of 319.34 g/mol. Its IUPAC name is 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.

Molecular Properties

Compound Name2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
PubChem CID36737555
Molecular FormulaC16H18FN3O3
Molecular Weight319.34 g/mol
Exact Mass319.13
IUPAC Name2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
SMILESCc1cc(NC(=O)CN2CCO[C@@H](c3ccc(F)cc3)C2)no1
InChIInChI=1S/C16H18FN3O3/c1-11-8-15(19-23-11)18-16(21)10-20-6-7-22-14(9-20)12-2-4-13(17)5-3-12/h2-5,8,14H,6-7,9-10H2,1H3,(H,18,19,21)/t14-/m1/s1
InChIKeyCCEUNYHHQAQISO-CQSZACIVSA-N
XLogP2.13
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)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-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The IUPAC name of 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide (CID 36737555) is 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide.
What is the SMILES notation for 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The canonical SMILES for 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is Cc1cc(NC(=O)CN2CCO[C@@H](c3ccc(F)cc3)C2)no1.
What is the InChIKey of 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
The InChIKey is CCEUNYHHQAQISO-CQSZACIVSA-N. The full InChI is InChI=1S/C16H18FN3O3/c1-11-8-15(19-23-11)18-16(21)10-20-6-7-22-14(9-20)12-2-4-13(17)5-3-12/h2-5,8,14H,6-7,9-10H2,1H3,(H,18,19,21)/t14-/m1/s1.
What are the key properties of 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide?
2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide has a molecular weight of 319.34 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-2-(4-fluorophenyl)morpholin-4-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide is sourced from PubChem (CID 36737555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).