2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide

C21H17Cl2NO2 — CID 7925219

IUPAC2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide
SMILESCc1ccc(Oc2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cc2)cc1
InChIInChI=1S/C21H17Cl2NO2/c1-14-2-7-17(8-3-14)26-18-9-5-16(6-10-18)24-21(25)13-15-4-11-19(22)20(23)12-15/h2-12H,13H2,1H3,(H,24,25)
InChIKeyFHRGWSFODFZIQF-UHFFFAOYSA-N
MW386.28 g/mol
LogP6.28
Rot. Bonds5

About 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide

2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide (PubChem CID 7925219) has the molecular formula C21H17Cl2NO2 and a molecular weight of 386.28 g/mol. Its IUPAC name is 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide
PubChem CID7925219
Molecular FormulaC21H17Cl2NO2
Molecular Weight386.28 g/mol
Exact Mass385.06
IUPAC Name2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide
SMILESCc1ccc(Oc2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cc2)cc1
InChIInChI=1S/C21H17Cl2NO2/c1-14-2-7-17(8-3-14)26-18-9-5-16(6-10-18)24-21(25)13-15-4-11-19(22)20(23)12-15/h2-12H,13H2,1H3,(H,24,25)
InChIKeyFHRGWSFODFZIQF-UHFFFAOYSA-N
XLogP6.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.28
LogP ≤ 56.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dichlorophenyl)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]acetamide
CID 2672755
2-(3,4-dichlorophenyl)-N-(4-propan-2-ylphenyl)acetamide
CID 7957082
2-(3,4-dichlorophenyl)-N-(3,4-dimethylphenyl)acetamide
CID 8743954
N-(4-bromophenyl)-2-(3,4-dichlorophenyl)acetamide
CID 2598783
2-(4-chlorophenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 5085866
(3,4-dichlorophenyl)methyl-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 2714126
N-(4-chloro-3-hydroxyphenyl)-2-(4-methylphenyl)acetamide
CID 64787693
N-[4-(2-bromoethyl)phenyl]-2-(3,4-dichlorophenyl)acetamide
CID 114310214
2-(4-acetamidophenyl)-N-[5-chloro-2-(4-methylphenoxy)phenyl]acetamide
CID 18195978
3-chloro-N-[4-(4-methylphenoxy)phenyl]propanamide
CID 43168007
2-(methylamino)-N-[4-(4-methylphenoxy)phenyl]acetamide
CID 18084877
2-(3,4-dimethylphenyl)-N-(4-methylphenyl)acetamide
CID 2664751

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide?
The IUPAC name of 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide (CID 7925219) is 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide.
What is the SMILES notation for 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide?
The canonical SMILES for 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide is Cc1ccc(Oc2ccc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cc2)cc1.
What is the InChIKey of 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide?
The InChIKey is FHRGWSFODFZIQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17Cl2NO2/c1-14-2-7-17(8-3-14)26-18-9-5-16(6-10-18)24-21(25)13-15-4-11-19(22)20(23)12-15/h2-12H,13H2,1H3,(H,24,25).
What are the key properties of 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide?
2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide has a molecular weight of 386.28 g/mol, XLogP of 6.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dichlorophenyl)-N-[4-(4-methylphenoxy)phenyl]acetamide is sourced from PubChem (CID 7925219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).