2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide

C20H23FN2O3 — CID 86982882

IUPAC2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1NC(=O)C(C)(C)Oc1ccc(F)cc1
InChIInChI=1S/C20H23FN2O3/c1-13(2)22-18(24)16-7-5-6-8-17(16)23-19(25)20(3,4)26-15-11-9-14(21)10-12-15/h5-13H,1-4H3,(H,22,24)(H,23,25)
InChIKeyXNGPJGVOLVFWPB-UHFFFAOYSA-N
MW358.41 g/mol
LogP3.76
Rot. Bonds6

About 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide

2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide (PubChem CID 86982882) has the molecular formula C20H23FN2O3 and a molecular weight of 358.41 g/mol. Its IUPAC name is 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide
PubChem CID86982882
Molecular FormulaC20H23FN2O3
Molecular Weight358.41 g/mol
Exact Mass358.17
IUPAC Name2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccccc1NC(=O)C(C)(C)Oc1ccc(F)cc1
InChIInChI=1S/C20H23FN2O3/c1-13(2)22-18(24)16-7-5-6-8-17(16)23-19(25)20(3,4)26-15-11-9-14(21)10-12-15/h5-13H,1-4H3,(H,22,24)(H,23,25)
InChIKeyXNGPJGVOLVFWPB-UHFFFAOYSA-N
XLogP3.76
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.41
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-fluorophenoxy)-N-(2-hydroxyphenyl)-2-methylpropanamide
CID 86978390
4-chloro-3-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide
CID 87026799
methyl 2-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]benzoate
CID 888208
N-[2-(2-amino-2-oxoethyl)phenyl]-2-(4-fluorophenoxy)-2-methylpropanamide
CID 86929205
2-(2-methylpropanoylamino)-N-propan-2-ylbenzamide
CID 34564562
2-(4-fluorophenoxy)-2-methylpropanehydrazide
CID 43236623
methyl 3-oxo-3-[2-(propan-2-ylcarbamoyl)anilino]propanoate
CID 28638001
2-(4-chlorophenoxy)-2-methyl-N-(2-methylphenyl)propanamide
CID 2184934
methyl 2-[[2,2-dimethyl-3-oxo-3-(propan-2-ylamino)propanoyl]amino]benzoate
CID 108957317
2-(4-chlorophenoxy)-2-methyl-N-[2-(trifluoromethyl)phenyl]propanamide
CID 5085201
2-[(2-phenoxybenzoyl)amino]-N-propan-2-ylbenzamide
CID 1251991
2-[[2-(2,5-dimethoxyphenyl)acetyl]amino]-N-propan-2-ylbenzamide
CID 78865415

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide?
The IUPAC name of 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide (CID 86982882) is 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide.
What is the SMILES notation for 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide?
The canonical SMILES for 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccccc1NC(=O)C(C)(C)Oc1ccc(F)cc1.
What is the InChIKey of 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide?
The InChIKey is XNGPJGVOLVFWPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O3/c1-13(2)22-18(24)16-7-5-6-8-17(16)23-19(25)20(3,4)26-15-11-9-14(21)10-12-15/h5-13H,1-4H3,(H,22,24)(H,23,25).
What are the key properties of 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide?
2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide has a molecular weight of 358.41 g/mol, XLogP of 3.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-fluorophenoxy)-2-methylpropanoyl]amino]-N-propan-2-ylbenzamide is sourced from PubChem (CID 86982882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).