N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide

C25H30FN3O3 — CID 24719677

IUPACN-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide
SMILESCCN(CC)c1onc(-c2ccc(F)cc2)c1CN(CCOC)C(=O)Cc1ccccc1
InChIInChI=1S/C25H30FN3O3/c1-4-28(5-2)25-22(24(27-32-25)20-11-13-21(26)14-12-20)18-29(15-16-31-3)23(30)17-19-9-7-6-8-10-19/h6-14H,4-5,15-18H2,1-3H3
InChIKeyOWUCZHCSQRSQCS-UHFFFAOYSA-N
MW439.53 g/mol
LogP4.54
Rot. Bonds11

About N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide

N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide (PubChem CID 24719677) has the molecular formula C25H30FN3O3 and a molecular weight of 439.53 g/mol. Its IUPAC name is N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide
PubChem CID24719677
Molecular FormulaC25H30FN3O3
Molecular Weight439.53 g/mol
Exact Mass439.23
IUPAC NameN-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide
SMILESCCN(CC)c1onc(-c2ccc(F)cc2)c1CN(CCOC)C(=O)Cc1ccccc1
InChIInChI=1S/C25H30FN3O3/c1-4-28(5-2)25-22(24(27-32-25)20-11-13-21(26)14-12-20)18-29(15-16-31-3)23(30)17-19-9-7-6-8-10-19/h6-14H,4-5,15-18H2,1-3H3
InChIKeyOWUCZHCSQRSQCS-UHFFFAOYSA-N
XLogP4.54
TPSA58.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.53
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide 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-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide?
The IUPAC name of N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide (CID 24719677) is N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide.
What is the SMILES notation for N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide?
The canonical SMILES for N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide is CCN(CC)c1onc(-c2ccc(F)cc2)c1CN(CCOC)C(=O)Cc1ccccc1.
What is the InChIKey of N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide?
The InChIKey is OWUCZHCSQRSQCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30FN3O3/c1-4-28(5-2)25-22(24(27-32-25)20-11-13-21(26)14-12-20)18-29(15-16-31-3)23(30)17-19-9-7-6-8-10-19/h6-14H,4-5,15-18H2,1-3H3.
What are the key properties of N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide?
N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide has a molecular weight of 439.53 g/mol, XLogP of 4.54, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(diethylamino)-3-(4-fluorophenyl)-1,2-oxazol-4-yl]methyl]-N-(2-methoxyethyl)-2-phenylacetamide is sourced from PubChem (CID 24719677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).