N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide

C16H16Cl2N2O — CID 54813314

IUPACN-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide
SMILESCc1cc(C)cc(NCC(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C16H16Cl2N2O/c1-10-5-11(2)7-13(6-10)19-9-16(21)20-15-8-12(17)3-4-14(15)18/h3-8,19H,9H2,1-2H3,(H,20,21)
InChIKeyOXCOXYYLDKTZEA-UHFFFAOYSA-N
MW323.22 g/mol
LogP4.66
Rot. Bonds4

About N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide

N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide (PubChem CID 54813314) has the molecular formula C16H16Cl2N2O and a molecular weight of 323.22 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide
PubChem CID54813314
Molecular FormulaC16H16Cl2N2O
Molecular Weight323.22 g/mol
Exact Mass322.06
IUPAC NameN-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide
SMILESCc1cc(C)cc(NCC(=O)Nc2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C16H16Cl2N2O/c1-10-5-11(2)7-13(6-10)19-9-16(21)20-15-8-12(17)3-4-14(15)18/h3-8,19H,9H2,1-2H3,(H,20,21)
InChIKeyOXCOXYYLDKTZEA-UHFFFAOYSA-N
XLogP4.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 4-[[2-(2,5-dichloroanilino)-2-oxoethyl]amino]benzoate
CID 9083030
2-(2-chloro-5-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 107634645
N-[3-[[2-(2,5-dichloroanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54830652
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-methylpropanamide
CID 47097183
2-(2,4-dichloroanilino)-N-(2,4-dichlorophenyl)acetamide
CID 54811499
2-(2-chloro-4-methylanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 9099362
2-(4-bromoanilino)-N-(5-chloro-2-methylphenyl)acetamide
CID 7492460
N-[3-[[2-(2,5-dichloroanilino)-2-oxoethyl]amino]phenyl]benzamide
CID 54839125
N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide
CID 108993299
2,5-dichloro-N-(3,5-dimethylphenyl)benzamide
CID 965625
N-[4-[[2-(2,5-dichloroanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54819782
methyl 2-[[2-(2,5-dichloroanilino)-2-oxoethyl]amino]benzoate
CID 55434529

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide (CID 54813314) is N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide is Cc1cc(C)cc(NCC(=O)Nc2cc(Cl)ccc2Cl)c1.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide?
The InChIKey is OXCOXYYLDKTZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O/c1-10-5-11(2)7-13(6-10)19-9-16(21)20-15-8-12(17)3-4-14(15)18/h3-8,19H,9H2,1-2H3,(H,20,21).
What are the key properties of N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide?
N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide has a molecular weight of 323.22 g/mol, XLogP of 4.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide is sourced from PubChem (CID 54813314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).