N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide

C15H10Cl2N2O2 — CID 26216328

IUPACN-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide
SMILESN#Cc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H10Cl2N2O2/c16-11-5-12(17)7-13(6-11)21-9-15(20)19-14-4-2-1-3-10(14)8-18/h1-7H,9H2,(H,19,20)
InChIKeyROQDYHNNJJUQDP-UHFFFAOYSA-N
MW321.16 g/mol
LogP3.88
Rot. Bonds4

About N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide

N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide (PubChem CID 26216328) has the molecular formula C15H10Cl2N2O2 and a molecular weight of 321.16 g/mol. Its IUPAC name is N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide
PubChem CID26216328
Molecular FormulaC15H10Cl2N2O2
Molecular Weight321.16 g/mol
Exact Mass320.01
IUPAC NameN-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide
SMILESN#Cc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1
InChIInChI=1S/C15H10Cl2N2O2/c16-11-5-12(17)7-13(6-11)21-9-15(20)19-14-4-2-1-3-10(14)8-18/h1-7H,9H2,(H,19,20)
InChIKeyROQDYHNNJJUQDP-UHFFFAOYSA-N
XLogP3.88
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.16
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2-cyanoanilino)-2-oxoethyl] 3,5-dichlorobenzoate
CID 2351055
2-[3,5-bis(trifluoromethyl)phenoxy]-N-(2-cyanophenyl)acetamide
CID 7796207
N-(2-cyanophenyl)-2-(2,4,5-trichlorophenoxy)acetamide
CID 4511857
N-(2-cyanophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7670915
2-[[2-(3,5-dichlorophenoxy)acetyl]amino]benzoic acid
CID 11302225
2-(4-chlorophenoxy)-N-[(2-cyanophenyl)carbamothioyl]acetamide
CID 920631
N-(2-cyanophenyl)-2-(2-methoxyphenoxy)acetamide
CID 922260
[2-(2-cyanoanilino)-2-oxoethyl] 5-chloro-2-fluorobenzoate
CID 8619878
N-(2-chlorophenyl)-2-(4-cyano-3-fluorophenoxy)acetamide
CID 78952552
2-(5-bromo-2-fluorophenoxy)-N-(2-cyanophenyl)acetamide
CID 115918411
N-(2-cyanophenyl)-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64854041
N-(2-cyanophenyl)-2-(2,4-dimethylphenoxy)acetamide
CID 876328

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide?
The IUPAC name of N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide (CID 26216328) is N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide.
What is the SMILES notation for N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide?
The canonical SMILES for N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide is N#Cc1ccccc1NC(=O)COc1cc(Cl)cc(Cl)c1.
What is the InChIKey of N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide?
The InChIKey is ROQDYHNNJJUQDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl2N2O2/c16-11-5-12(17)7-13(6-11)21-9-15(20)19-14-4-2-1-3-10(14)8-18/h1-7H,9H2,(H,19,20).
What are the key properties of N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide?
N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide has a molecular weight of 321.16 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-2-(3,5-dichlorophenoxy)acetamide is sourced from PubChem (CID 26216328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).