N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide

C18H17F4NO2 — CID 7467725

IUPACN-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
SMILESCCc1cccc(CC)c1NC(=O)COc1c(F)c(F)cc(F)c1F
InChIInChI=1S/C18H17F4NO2/c1-3-10-6-5-7-11(4-2)17(10)23-14(24)9-25-18-15(21)12(19)8-13(20)16(18)22/h5-8H,3-4,9H2,1-2H3,(H,23,24)
InChIKeyNDGIWBQKSZBTCY-UHFFFAOYSA-N
MW355.33 g/mol
LogP4.39
Rot. Bonds6

About N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide

N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide (PubChem CID 7467725) has the molecular formula C18H17F4NO2 and a molecular weight of 355.33 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
PubChem CID7467725
Molecular FormulaC18H17F4NO2
Molecular Weight355.33 g/mol
Exact Mass355.12
IUPAC NameN-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
SMILESCCc1cccc(CC)c1NC(=O)COc1c(F)c(F)cc(F)c1F
InChIInChI=1S/C18H17F4NO2/c1-3-10-6-5-7-11(4-2)17(10)23-14(24)9-25-18-15(21)12(19)8-13(20)16(18)22/h5-8H,3-4,9H2,1-2H3,(H,23,24)
InChIKeyNDGIWBQKSZBTCY-UHFFFAOYSA-N
XLogP4.39
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.33
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

N-(2-fluorophenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2558525
N-(3-methylsulfanylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 112778206
N-(2,6-diethylphenyl)-2-(2-propoxyphenoxy)acetamide
CID 78767853
2-(3,5-dichlorophenoxy)-N-(2,6-diethylphenyl)acetamide
CID 7467237
N-(2-bromophenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 2558535
N-(5-methyl-2-pyridinyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 681610
N-(2-ethyl-6-methylphenyl)-2-(2,3,4,5,6-pentachlorophenoxy)acetamide
CID 19178089
2-(3-acetamidophenoxy)-N-(2,6-diethylphenyl)acetamide
CID 7697860
2-(2,4-dichloro-6-formylphenoxy)-N-(2,6-diethylphenyl)acetamide
CID 28913352
2-(4-acetamidophenoxy)-N-(2,6-diethylphenyl)acetamide
CID 2606243
N-(2,6-diethylphenyl)-2-(5-fluoro-2-nitrophenoxy)acetamide
CID 2690932
2-[2-(2,6-diethylanilino)-2-oxoethoxy]-3-methoxybenzamide
CID 46796577

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
The IUPAC name of N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide (CID 7467725) is N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
The canonical SMILES for N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide is CCc1cccc(CC)c1NC(=O)COc1c(F)c(F)cc(F)c1F.
What is the InChIKey of N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
The InChIKey is NDGIWBQKSZBTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F4NO2/c1-3-10-6-5-7-11(4-2)17(10)23-14(24)9-25-18-15(21)12(19)8-13(20)16(18)22/h5-8H,3-4,9H2,1-2H3,(H,23,24).
What are the key properties of N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide?
N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide has a molecular weight of 355.33 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide is sourced from PubChem (CID 7467725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).