N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide

C21H17Cl2NO2 — CID 2515961

IUPACN-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
SMILESCc1ccc(-c2ccc(OCC(=O)Nc3ccc(Cl)cc3Cl)cc2)cc1
InChIInChI=1S/C21H17Cl2NO2/c1-14-2-4-15(5-3-14)16-6-9-18(10-7-16)26-13-21(25)24-20-11-8-17(22)12-19(20)23/h2-12H,13H2,1H3,(H,24,25)
InChIKeyDPVDMRXLLAEXBD-UHFFFAOYSA-N
MW386.28 g/mol
LogP5.99
Rot. Bonds5

About N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide

N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide (PubChem CID 2515961) has the molecular formula C21H17Cl2NO2 and a molecular weight of 386.28 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
PubChem CID2515961
Molecular FormulaC21H17Cl2NO2
Molecular Weight386.28 g/mol
Exact Mass385.06
IUPAC NameN-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
SMILESCc1ccc(-c2ccc(OCC(=O)Nc3ccc(Cl)cc3Cl)cc2)cc1
InChIInChI=1S/C21H17Cl2NO2/c1-14-2-4-15(5-3-14)16-6-9-18(10-7-16)26-13-21(25)24-20-11-8-17(22)12-19(20)23/h2-12H,13H2,1H3,(H,24,25)
InChIKeyDPVDMRXLLAEXBD-UHFFFAOYSA-N
XLogP5.99
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 ≤ 55.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chloro-2-methylphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 19174143
2-[4-(4-cyanophenyl)phenoxy]-N-(2,4-dichlorophenyl)acetamide
CID 1034300
2-(4-tert-butylphenoxy)-N-(2,4-dichlorophenyl)acetamide
CID 3380157
N-(5-chloro-2-hydroxyphenyl)-2-(4-methylphenoxy)acetamide
CID 836090
2-(4-chlorophenoxy)-N-[2-[[2-(4-chlorophenoxy)acetyl]amino]-4-methylphenyl]acetamide
CID 1293205
2-[4-[(2,4-dichloroanilino)methyl]phenoxy]-N-(4-methylphenyl)acetamide
CID 66539227
N-(2,4-dichlorophenyl)-2-(4-octoxyphenoxy)acetamide
CID 4733017
N'-[[4-[2-(2,4-dichloroanilino)-2-oxoethoxy]phenyl]methylideneamino]-N-(4-methylphenyl)oxamide
CID 3464017
2-[4-[(2R)-butan-2-yl]phenoxy]-N-(2,4-dichlorophenyl)acetamide
CID 40666473
[2-(2,4-dichloroanilino)-2-oxoethyl] 2-(4-chlorophenoxy)acetate
CID 7750749
N-(2-chloro-4-methylphenyl)-2-(4-methylsulfanylphenoxy)acetamide
CID 7893677
N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide
CID 1184723

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide (CID 2515961) is N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide is Cc1ccc(-c2ccc(OCC(=O)Nc3ccc(Cl)cc3Cl)cc2)cc1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide?
The InChIKey is DPVDMRXLLAEXBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17Cl2NO2/c1-14-2-4-15(5-3-14)16-6-9-18(10-7-16)26-13-21(25)24-20-11-8-17(22)12-19(20)23/h2-12H,13H2,1H3,(H,24,25).
What are the key properties of N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide?
N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide has a molecular weight of 386.28 g/mol, XLogP of 5.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phenoxy]acetamide is sourced from PubChem (CID 2515961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).