2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide

C19H22FNO2 — CID 675188

IUPAC2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide
SMILESCc1ccc(C(C)(C)C)c(OCC(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C19H22FNO2/c1-13-5-10-16(19(2,3)4)17(11-13)23-12-18(22)21-15-8-6-14(20)7-9-15/h5-11H,12H2,1-4H3,(H,21,22)
InChIKeyVGZNPLAOBBMMKV-UHFFFAOYSA-N
MW315.39 g/mol
LogP4.45
Rot. Bonds4

About 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide

2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide (PubChem CID 675188) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide
PubChem CID675188
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC Name2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide
SMILESCc1ccc(C(C)(C)C)c(OCC(=O)Nc2ccc(F)cc2)c1
InChIInChI=1S/C19H22FNO2/c1-13-5-10-16(19(2,3)4)17(11-13)23-12-18(22)21-15-8-6-14(20)7-9-15/h5-11H,12H2,1-4H3,(H,21,22)
InChIKeyVGZNPLAOBBMMKV-UHFFFAOYSA-N
XLogP4.45
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide 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-(2-tert-butyl-5-methylphenoxy)-N-methylacetamide
CID 19168129
2-[2-(aminomethyl)-4-methylphenoxy]-N-(4-fluorophenyl)acetamide
CID 63322519
2-(2-chloro-4-fluorophenoxy)-N-(4-methylphenyl)acetamide
CID 9402450
2-(2-tert-butyl-5-methylphenoxy)-N-(2-chlorophenyl)acetamide
CID 725942
2-(2-tert-butyl-5-methylphenoxy)-N-(2-ethylphenyl)acetamide
CID 19168145
2-(2-tert-butyl-5-methylphenoxy)-N-(2-methylpropyl)acetamide
CID 19165047
1-[(2-tert-butyl-4-methylphenoxy)methyl]-3-(4-fluorophenyl)urea
CID 108877565
2-(2,5-dimethylphenoxy)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 17071565
2-[[2-(2-tert-butyl-5-methylphenoxy)acetyl]amino]propanoic acid
CID 16642061
2-(2,5-dimethylphenoxy)-N-[(4-fluorophenyl)carbamothioyl]acetamide
CID 916660
4-tert-butyl-N-[4-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]benzamide
CID 17235006
2-(2,4-difluorophenoxy)-N-(4-fluorophenyl)acetamide
CID 580280

Frequently Asked Questions

What is the IUPAC name of 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide (CID 675188) is 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide is Cc1ccc(C(C)(C)C)c(OCC(=O)Nc2ccc(F)cc2)c1.
What is the InChIKey of 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide?
The InChIKey is VGZNPLAOBBMMKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-13-5-10-16(19(2,3)4)17(11-13)23-12-18(22)21-15-8-6-14(20)7-9-15/h5-11H,12H2,1-4H3,(H,21,22).
What are the key properties of 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide?
2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide has a molecular weight of 315.39 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-tert-butyl-5-methylphenoxy)-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 675188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).