N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide

C19H21F2NO2 — CID 133219467

IUPACN-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
SMILESCc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccc(F)cc2F)c1
InChIInChI=1S/C19H21F2NO2/c1-11(2)15-7-5-12(3)9-18(15)24-13(4)19(23)22-17-8-6-14(20)10-16(17)21/h5-11,13H,1-4H3,(H,22,23)
InChIKeyYZKZIDIFEXAKHU-UHFFFAOYSA-N
MW333.38 g/mol
LogP4.80
Rot. Bonds5

About N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide

N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide (PubChem CID 133219467) has the molecular formula C19H21F2NO2 and a molecular weight of 333.38 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
PubChem CID133219467
Molecular FormulaC19H21F2NO2
Molecular Weight333.38 g/mol
Exact Mass333.15
IUPAC NameN-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
SMILESCc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccc(F)cc2F)c1
InChIInChI=1S/C19H21F2NO2/c1-11(2)15-7-5-12(3)9-18(15)24-13(4)19(23)22-17-8-6-14(20)10-16(17)21/h5-11,13H,1-4H3,(H,22,23)
InChIKeyYZKZIDIFEXAKHU-UHFFFAOYSA-N
XLogP4.80
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.38
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133219312
N-(2-ethoxyphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 134012633
N-(2,4-difluorophenyl)-2-(2-methoxyphenoxy)propanamide
CID 53286451
N-(2,5-dimethoxyphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 112778600
2-(5-methyl-2-propan-2-ylphenoxy)-N-(2-phenylphenyl)propanamide
CID 133162179
N-[2-[(4-chlorophenyl)methylsulfanyl]phenyl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 133201946
(2R)-N-(2-benzoylphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100679238
2-(5-methyl-2-propan-2-ylphenoxy)-N-(8-methylquinolin-5-yl)propanamide
CID 51065828
(2R)-N-[(2R)-3-methylbutan-2-yl]-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 100572381
[(2S)-1-(2,4-difluoroanilino)-1-oxopropan-2-yl] (2S)-2-(3-methylphenoxy)propanoate
CID 8737879
(2R)-N-(3-methoxyphenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide
CID 95310662
methyl 2-hydroxy-3-[2-(5-methyl-2-propan-2-ylphenoxy)propanoylamino]benzoate
CID 56576066

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide (CID 133219467) is N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide is Cc1ccc(C(C)C)c(OC(C)C(=O)Nc2ccc(F)cc2F)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
The InChIKey is YZKZIDIFEXAKHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21F2NO2/c1-11(2)15-7-5-12(3)9-18(15)24-13(4)19(23)22-17-8-6-14(20)10-16(17)21/h5-11,13H,1-4H3,(H,22,23).
What are the key properties of N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide?
N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide has a molecular weight of 333.38 g/mol, XLogP of 4.80, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-(5-methyl-2-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 133219467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).