2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide

C17H17ClF2N2O3 — CID 9102876

IUPAC2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide
SMILESCOc1cc(Cl)c(C)cc1NCC(=O)Nc1ccc(OC(F)F)cc1
InChIInChI=1S/C17H17ClF2N2O3/c1-10-7-14(15(24-2)8-13(10)18)21-9-16(23)22-11-3-5-12(6-4-11)25-17(19)20/h3-8,17,21H,9H2,1-2H3,(H,22,23)
InChIKeyARLOSGIWOWOSMX-UHFFFAOYSA-N
MW370.78 g/mol
LogP4.31
Rot. Bonds7

About 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide

2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide (PubChem CID 9102876) has the molecular formula C17H17ClF2N2O3 and a molecular weight of 370.78 g/mol. Its IUPAC name is 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide
PubChem CID9102876
Molecular FormulaC17H17ClF2N2O3
Molecular Weight370.78 g/mol
Exact Mass370.09
IUPAC Name2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide
SMILESCOc1cc(Cl)c(C)cc1NCC(=O)Nc1ccc(OC(F)F)cc1
InChIInChI=1S/C17H17ClF2N2O3/c1-10-7-14(15(24-2)8-13(10)18)21-9-16(23)22-11-3-5-12(6-4-11)25-17(19)20/h3-8,17,21H,9H2,1-2H3,(H,22,23)
InChIKeyARLOSGIWOWOSMX-UHFFFAOYSA-N
XLogP4.31
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.78
LogP ≤ 54.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chloro-2-methoxy-5-methylanilino)-N-[2-(difluoromethoxy)phenyl]acetamide
CID 9102880
2-(2,5-dichloroanilino)-N-[4-(difluoromethoxy)phenyl]acetamide
CID 26417029
2-[5-(cyclopropylsulfamoyl)-2-methoxyanilino]-N-[4-(difluoromethoxy)phenyl]acetamide
CID 37174879
2-[4-(difluoromethoxy)anilino]-N-(2,5-dimethoxyphenyl)acetamide
CID 36585879
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(3,4-difluoroanilino)acetamide
CID 109011257
4-[[2-(4-chloro-2,5-dimethoxyanilino)acetyl]amino]benzamide
CID 46633585
3-(4-chloro-2-methoxy-5-methylanilino)-N-(4-propan-2-ylphenyl)propanamide
CID 109036891
2-(5-chloro-2-methoxyanilino)-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 26417292
2-(4-chloro-2-methoxy-5-methylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 47123138
2-(4-chloro-2-methoxy-5-methylanilino)-N-(2-propan-2-ylphenyl)acetamide
CID 109007861
2-(4-chloro-2,5-dimethoxyanilino)-N-(3,4-dichlorophenyl)acetamide
CID 9106808
2-(4-chloro-2-methoxy-5-methylanilino)-N-(2-phenoxyphenyl)acetamide
CID 109011102

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide (CID 9102876) is 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide is COc1cc(Cl)c(C)cc1NCC(=O)Nc1ccc(OC(F)F)cc1.
What is the InChIKey of 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide?
The InChIKey is ARLOSGIWOWOSMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17ClF2N2O3/c1-10-7-14(15(24-2)8-13(10)18)21-9-16(23)22-11-3-5-12(6-4-11)25-17(19)20/h3-8,17,21H,9H2,1-2H3,(H,22,23).
What are the key properties of 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide?
2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide has a molecular weight of 370.78 g/mol, XLogP of 4.31, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methoxy-5-methylanilino)-N-[4-(difluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 9102876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).