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

C19H16F2N2O3 — CID 17254007

IUPACN-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide
SMILESO=C(COCc1cc(-c2ccc(F)cc2)on1)NCc1ccc(F)cc1
InChIInChI=1S/C19H16F2N2O3/c20-15-5-1-13(2-6-15)10-22-19(24)12-25-11-17-9-18(26-23-17)14-3-7-16(21)8-4-14/h1-9H,10-12H2,(H,22,24)
InChIKeyCKLYCIFACYQXRQ-UHFFFAOYSA-N
MW358.34 g/mol
LogP3.45
Rot. Bonds7

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

N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide (PubChem CID 17254007) has the molecular formula C19H16F2N2O3 and a molecular weight of 358.34 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide
PubChem CID17254007
Molecular FormulaC19H16F2N2O3
Molecular Weight358.34 g/mol
Exact Mass358.11
IUPAC NameN-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide
SMILESO=C(COCc1cc(-c2ccc(F)cc2)on1)NCc1ccc(F)cc1
InChIInChI=1S/C19H16F2N2O3/c20-15-5-1-13(2-6-15)10-22-19(24)12-25-11-17-9-18(26-23-17)14-3-7-16(21)8-4-14/h1-9H,10-12H2,(H,22,24)
InChIKeyCKLYCIFACYQXRQ-UHFFFAOYSA-N
XLogP3.45
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide (CID 17254007) is N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide is O=C(COCc1cc(-c2ccc(F)cc2)on1)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide?
The InChIKey is CKLYCIFACYQXRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O3/c20-15-5-1-13(2-6-15)10-22-19(24)12-25-11-17-9-18(26-23-17)14-3-7-16(21)8-4-14/h1-9H,10-12H2,(H,22,24).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide?
N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide has a molecular weight of 358.34 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methoxy]acetamide is sourced from PubChem (CID 17254007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).