N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine

C24H21FN2O — CID 56662118

IUPACN-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine
SMILESFc1ccccc1-c1nc(CNCC(c2ccccc2)c2ccccc2)co1
InChIInChI=1S/C24H21FN2O/c25-23-14-8-7-13-21(23)24-27-20(17-28-24)15-26-16-22(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-14,17,22,26H,15-16H2
InChIKeyZCYMUYNLJBTDFV-UHFFFAOYSA-N
MW372.44 g/mol
LogP5.40
Rot. Bonds7

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

N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine (PubChem CID 56662118) has the molecular formula C24H21FN2O and a molecular weight of 372.44 g/mol. Its IUPAC name is N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine.

Molecular Properties

Compound NameN-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine
PubChem CID56662118
Molecular FormulaC24H21FN2O
Molecular Weight372.44 g/mol
Exact Mass372.16
IUPAC NameN-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine
SMILESFc1ccccc1-c1nc(CNCC(c2ccccc2)c2ccccc2)co1
InChIInChI=1S/C24H21FN2O/c25-23-14-8-7-13-21(23)24-27-20(17-28-24)15-26-16-22(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-14,17,22,26H,15-16H2
InChIKeyZCYMUYNLJBTDFV-UHFFFAOYSA-N
XLogP5.40
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.44
LogP ≤ 55.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine 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-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine?
The IUPAC name of N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine (CID 56662118) is N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine.
What is the SMILES notation for N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine?
The canonical SMILES for N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine is Fc1ccccc1-c1nc(CNCC(c2ccccc2)c2ccccc2)co1.
What is the InChIKey of N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine?
The InChIKey is ZCYMUYNLJBTDFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN2O/c25-23-14-8-7-13-21(23)24-27-20(17-28-24)15-26-16-22(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-14,17,22,26H,15-16H2.
What are the key properties of N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine?
N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine has a molecular weight of 372.44 g/mol, XLogP of 5.40, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-fluorophenyl)-1,3-oxazol-4-yl]methyl]-2,2-diphenylethanamine is sourced from PubChem (CID 56662118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).