N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide

C15H11Cl2N3O — CID 26416996

IUPACN-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide
SMILESN#Cc1ccc(NC(=O)CNc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C15H11Cl2N3O/c16-11-3-6-13(17)14(7-11)19-9-15(21)20-12-4-1-10(8-18)2-5-12/h1-7,19H,9H2,(H,20,21)
InChIKeyYAVJPELWOIPIRN-UHFFFAOYSA-N
MW320.18 g/mol
LogP3.92
Rot. Bonds4

About N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide

N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide (PubChem CID 26416996) has the molecular formula C15H11Cl2N3O and a molecular weight of 320.18 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide
PubChem CID26416996
Molecular FormulaC15H11Cl2N3O
Molecular Weight320.18 g/mol
Exact Mass319.03
IUPAC NameN-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide
SMILESN#Cc1ccc(NC(=O)CNc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C15H11Cl2N3O/c16-11-3-6-13(17)14(7-11)19-9-15(21)20-12-4-1-10(8-18)2-5-12/h1-7,19H,9H2,(H,20,21)
InChIKeyYAVJPELWOIPIRN-UHFFFAOYSA-N
XLogP3.92
TPSA64.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.18
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-fluorophenyl)-2-(4-cyanoanilino)acetamide
CID 51183099
2-(3-chloro-4-fluoroanilino)-N-(4-cyanophenyl)acetamide
CID 9099605
N-[4-[[2-(2,5-dichloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54819782
2-(5-chloro-2-cyanoanilino)-N-(4-methylphenyl)acetamide
CID 64918984
2-(5-bromo-2-chloroanilino)-N-(4-chlorophenyl)acetamide
CID 63492462
N-tert-butyl-4-[[2-(2,5-dichloroanilino)acetyl]amino]benzamide
CID 54819548
2-(2,5-dichloroanilino)-N-[4-(difluoromethoxy)phenyl]acetamide
CID 26417029
2-(2,5-dichloroanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54819813
2-(2-chloro-5-methylanilino)-N-(4-methylphenyl)acetamide
CID 103768034
1-N-(4-cyanophenyl)-1-N'-(2,5-dichlorophenyl)cyclopropane-1,1-dicarboxamide
CID 108983806
2-(5-chloro-2-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 43385683
N-[3-[[2-(2,5-dichloroanilino)acetyl]amino]phenyl]-2,2-dimethylpropanamide
CID 54819617

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide?
The IUPAC name of N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide (CID 26416996) is N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide?
The canonical SMILES for N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide is N#Cc1ccc(NC(=O)CNc2cc(Cl)ccc2Cl)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide?
The InChIKey is YAVJPELWOIPIRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3O/c16-11-3-6-13(17)14(7-11)19-9-15(21)20-12-4-1-10(8-18)2-5-12/h1-7,19H,9H2,(H,20,21).
What are the key properties of N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide?
N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide has a molecular weight of 320.18 g/mol, XLogP of 3.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-(2,5-dichloroanilino)acetamide is sourced from PubChem (CID 26416996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).