N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide

C18H19F2NO4 — CID 24660317

IUPACN-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide
SMILESCOc1ccc(NC(=O)COc2cc(C)ccc2C)cc1OC(F)F
InChIInChI=1S/C18H19F2NO4/c1-11-4-5-12(2)15(8-11)24-10-17(22)21-13-6-7-14(23-3)16(9-13)25-18(19)20/h4-9,18H,10H2,1-3H3,(H,21,22)
InChIKeyLCAJKEPSALBDES-UHFFFAOYSA-N
MW351.35 g/mol
LogP3.93
Rot. Bonds7

About N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide

N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide (PubChem CID 24660317) has the molecular formula C18H19F2NO4 and a molecular weight of 351.35 g/mol. Its IUPAC name is N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide
PubChem CID24660317
Molecular FormulaC18H19F2NO4
Molecular Weight351.35 g/mol
Exact Mass351.13
IUPAC NameN-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide
SMILESCOc1ccc(NC(=O)COc2cc(C)ccc2C)cc1OC(F)F
InChIInChI=1S/C18H19F2NO4/c1-11-4-5-12(2)15(8-11)24-10-17(22)21-13-6-7-14(23-3)16(9-13)25-18(19)20/h4-9,18H,10H2,1-3H3,(H,21,22)
InChIKeyLCAJKEPSALBDES-UHFFFAOYSA-N
XLogP3.93
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.35
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 807483
2-amino-N-[3-(difluoromethoxy)-4-methoxyphenyl]acetamide
CID 43712827
N-[3-(difluoromethoxy)-4-methoxyphenyl]-3,3-dimethylbutanamide
CID 46450594
2-(2,5-dimethylphenoxy)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 17071565
4-amino-N-[3-(difluoromethoxy)-4-methoxyphenyl]butanamide
CID 43712833
N-[3-[[2-(2,5-dimethylphenoxy)acetyl]amino]phenyl]propanamide
CID 17188255
2-(2-chloro-5-methylphenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 7642767
2-amino-N-[3-[[2-(2,5-dimethylphenoxy)acetyl]amino]-4-methylphenyl]acetamide
CID 39192494
N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 19174454
[2-(3,4-diethoxyanilino)-2-oxoethyl] 2-(2,5-dimethylphenoxy)acetate
CID 8918544
N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 18166231
[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 2-(2,5-dimethylphenoxy)acetate
CID 40706586

Frequently Asked Questions

What is the IUPAC name of N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide?
The IUPAC name of N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide (CID 24660317) is N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide.
What is the SMILES notation for N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide?
The canonical SMILES for N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide is COc1ccc(NC(=O)COc2cc(C)ccc2C)cc1OC(F)F.
What is the InChIKey of N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide?
The InChIKey is LCAJKEPSALBDES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F2NO4/c1-11-4-5-12(2)15(8-11)24-10-17(22)21-13-6-7-14(23-3)16(9-13)25-18(19)20/h4-9,18H,10H2,1-3H3,(H,21,22).
What are the key properties of N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide?
N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide has a molecular weight of 351.35 g/mol, XLogP of 3.93, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(2,5-dimethylphenoxy)acetamide is sourced from PubChem (CID 24660317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).