N-[4-(2,6-dichloroanilino)phenyl]acetamide

C14H12Cl2N2O — CID 112989665

IUPACN-[4-(2,6-dichloroanilino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C14H12Cl2N2O/c1-9(19)17-10-5-7-11(8-6-10)18-14-12(15)3-2-4-13(14)16/h2-8,18H,1H3,(H,17,19)
InChIKeyMZHUCNZNKLATPH-UHFFFAOYSA-N
MW295.17 g/mol
LogP4.70
Rot. Bonds3

About N-[4-(2,6-dichloroanilino)phenyl]acetamide

N-[4-(2,6-dichloroanilino)phenyl]acetamide (PubChem CID 112989665) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is N-[4-(2,6-dichloroanilino)phenyl]acetamide.

Molecular Properties

Compound NameN-[4-(2,6-dichloroanilino)phenyl]acetamide
PubChem CID112989665
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC NameN-[4-(2,6-dichloroanilino)phenyl]acetamide
SMILESCC(=O)Nc1ccc(Nc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C14H12Cl2N2O/c1-9(19)17-10-5-7-11(8-6-10)18-14-12(15)3-2-4-13(14)16/h2-8,18H,1H3,(H,17,19)
InChIKeyMZHUCNZNKLATPH-UHFFFAOYSA-N
XLogP4.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 54.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[(2-chloro-6-fluorophenyl)carbamoylamino]phenyl]acetamide
CID 108896360
4-(2,6-dichloroanilino)benzoic acid
CID 65499202
N-[4-(4-chloroanilino)phenyl]acetamide
CID 71397904
N-[4-(2,6-dichloroanilino)phenyl]methanesulfonamide
CID 112989678
N-[3-[[6-(2,6-dichloroanilino)pyrimidin-4-yl]amino]phenyl]acetamide
CID 112866731
N-(2-chloro-6-ethylphenyl)acetamide
CID 130011952
N-[4-[(2,6-dichlorophenyl)methoxy]phenyl]acetamide
CID 7640056
methyl N-[4-(2,3-dichloroanilino)phenyl]carbamate
CID 112989692
(E)-3-(4-acetamidophenyl)-2-cyano-N-(2,6-dichlorophenyl)prop-2-enamide
CID 7912146
N-(4-acetamidophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54816111
(2R)-N-(4-acetamidophenyl)-2-(2,6-dichlorophenyl)sulfanylpropanamide
CID 7847766
N-(2-chloro-6-prop-1-en-2-ylphenyl)acetamide
CID 130011916

Frequently Asked Questions

What is the IUPAC name of N-[4-(2,6-dichloroanilino)phenyl]acetamide?
The IUPAC name of N-[4-(2,6-dichloroanilino)phenyl]acetamide (CID 112989665) is N-[4-(2,6-dichloroanilino)phenyl]acetamide.
What is the SMILES notation for N-[4-(2,6-dichloroanilino)phenyl]acetamide?
The canonical SMILES for N-[4-(2,6-dichloroanilino)phenyl]acetamide is CC(=O)Nc1ccc(Nc2c(Cl)cccc2Cl)cc1.
What is the InChIKey of N-[4-(2,6-dichloroanilino)phenyl]acetamide?
The InChIKey is MZHUCNZNKLATPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c1-9(19)17-10-5-7-11(8-6-10)18-14-12(15)3-2-4-13(14)16/h2-8,18H,1H3,(H,17,19).
What are the key properties of N-[4-(2,6-dichloroanilino)phenyl]acetamide?
N-[4-(2,6-dichloroanilino)phenyl]acetamide has a molecular weight of 295.17 g/mol, XLogP of 4.70, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2,6-dichloroanilino)phenyl]acetamide is sourced from PubChem (CID 112989665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).