2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide

C19H22FNO2 — CID 42989700

IUPAC2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCc1ccc(F)cc1NC(=O)COc1cccc(C(C)(C)C)c1
InChIInChI=1S/C19H22FNO2/c1-13-8-9-15(20)11-17(13)21-18(22)12-23-16-7-5-6-14(10-16)19(2,3)4/h5-11H,12H2,1-4H3,(H,21,22)
InChIKeyBSBIWSYBIZSJOK-UHFFFAOYSA-N
MW315.39 g/mol
LogP4.45
Rot. Bonds4

About 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide

2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide (PubChem CID 42989700) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
PubChem CID42989700
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC Name2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
SMILESCc1ccc(F)cc1NC(=O)COc1cccc(C(C)(C)C)c1
InChIInChI=1S/C19H22FNO2/c1-13-8-9-15(20)11-17(13)21-18(22)12-23-16-7-5-6-14(10-16)19(2,3)4/h5-11H,12H2,1-4H3,(H,21,22)
InChIKeyBSBIWSYBIZSJOK-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

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Related Compounds

2-(3-acetylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 2454873
N-(4-fluoro-2-methylphenyl)-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 7980515
2-(3-tert-butylphenoxy)-N-(2,4-dimethylphenyl)acetamide
CID 112977615
2-(4-ethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 804157
2-(3-tert-butylphenoxy)-N-(2-ethylphenyl)acetamide
CID 112977620
ethyl 4-methyl-3-[[2-[3-(trifluoromethyl)phenoxy]acetyl]amino]benzoate
CID 100757931
2-(4-cyanophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 7961641
3-(4-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)propanamide
CID 18208025
methyl 2-[[2-(3-tert-butylphenoxy)acetyl]amino]benzoate
CID 112977644
2-(2-acetamidophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 2472167
2-(2,5-dimethylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 35728477
2-[2-(5-fluoro-2-methylanilino)-2-oxoethoxy]benzamide
CID 18100358

Frequently Asked Questions

What is the IUPAC name of 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The IUPAC name of 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide (CID 42989700) is 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The canonical SMILES for 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide is Cc1ccc(F)cc1NC(=O)COc1cccc(C(C)(C)C)c1.
What is the InChIKey of 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
The InChIKey is BSBIWSYBIZSJOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c1-13-8-9-15(20)11-17(13)21-18(22)12-23-16-7-5-6-14(10-16)19(2,3)4/h5-11H,12H2,1-4H3,(H,21,22).
What are the key properties of 2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide?
2-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)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-(3-tert-butylphenoxy)-N-(5-fluoro-2-methylphenyl)acetamide is sourced from PubChem (CID 42989700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).