2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide

C21H17ClF2N2O3 — CID 35822670

IUPAC2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESO=C(CNc1ccccc1Oc1ccccc1Cl)Nc1ccccc1OC(F)F
InChIInChI=1S/C21H17ClF2N2O3/c22-14-7-1-4-10-17(14)28-18-11-5-2-8-15(18)25-13-20(27)26-16-9-3-6-12-19(16)29-21(23)24/h1-12,21,25H,13H2,(H,26,27)
InChIKeyZXOKDBPPPZHGEO-UHFFFAOYSA-N
MW418.83 g/mol
LogP5.78
Rot. Bonds8

About 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide

2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide (PubChem CID 35822670) has the molecular formula C21H17ClF2N2O3 and a molecular weight of 418.83 g/mol. Its IUPAC name is 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide
PubChem CID35822670
Molecular FormulaC21H17ClF2N2O3
Molecular Weight418.83 g/mol
Exact Mass418.09
IUPAC Name2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide
SMILESO=C(CNc1ccccc1Oc1ccccc1Cl)Nc1ccccc1OC(F)F
InChIInChI=1S/C21H17ClF2N2O3/c22-14-7-1-4-10-17(14)28-18-11-5-2-8-15(18)25-13-20(27)26-16-9-3-6-12-19(16)29-21(23)24/h1-12,21,25H,13H2,(H,26,27)
InChIKeyZXOKDBPPPZHGEO-UHFFFAOYSA-N
XLogP5.78
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.83
LogP ≤ 55.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(difluoromethoxy)phenyl]-2-(2-ethoxyanilino)acetamide
CID 9102233
2-(4-chloro-2-methoxy-5-methylanilino)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 9102880
2-[(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)amino]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 37223693
2-(2-chloroanilino)-N-(2-phenoxyphenyl)acetamide
CID 9098717
2-(3-chloro-2-methylanilino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54812884
methyl 3-[[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]amino]-2-methylbenzoate
CID 34075412
N-[2-(difluoromethoxy)phenyl]-2-(4-methoxy-2-methylanilino)acetamide
CID 51108580
2-chloro-N-[3-[2-(difluoromethoxy)anilino]-3-oxopropyl]benzamide
CID 7941475
[2-[2-(difluoromethoxy)anilino]-2-oxoethyl] 2-(2,6-dichlorophenyl)acetate
CID 2399542
[(1S)-1-(2-chlorophenyl)ethyl]-[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]azanium
CID 8598301
2-[(2-chlorophenyl)methyl-methylamino]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 34115631
2-[3-chloro-4-(difluoromethoxy)anilino]-N-(2-fluorophenyl)acetamide
CID 9103338

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide (CID 35822670) is 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide is O=C(CNc1ccccc1Oc1ccccc1Cl)Nc1ccccc1OC(F)F.
What is the InChIKey of 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide?
The InChIKey is ZXOKDBPPPZHGEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17ClF2N2O3/c22-14-7-1-4-10-17(14)28-18-11-5-2-8-15(18)25-13-20(27)26-16-9-3-6-12-19(16)29-21(23)24/h1-12,21,25H,13H2,(H,26,27).
What are the key properties of 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide?
2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide has a molecular weight of 418.83 g/mol, XLogP of 5.78, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenoxy)anilino]-N-[2-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 35822670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).