N-benzyl-2-(2,4,6-trichloroanilino)acetamide

C15H13Cl3N2O — CID 28992616

IUPACN-benzyl-2-(2,4,6-trichloroanilino)acetamide
SMILESO=C(CNc1c(Cl)cc(Cl)cc1Cl)NCc1ccccc1
InChIInChI=1S/C15H13Cl3N2O/c16-11-6-12(17)15(13(18)7-11)20-9-14(21)19-8-10-4-2-1-3-5-10/h1-7,20H,8-9H2,(H,19,21)
InChIKeyIQACVFHDUULYFN-UHFFFAOYSA-N
MW343.64 g/mol
LogP4.38
Rot. Bonds5

About N-benzyl-2-(2,4,6-trichloroanilino)acetamide

N-benzyl-2-(2,4,6-trichloroanilino)acetamide (PubChem CID 28992616) has the molecular formula C15H13Cl3N2O and a molecular weight of 343.64 g/mol. Its IUPAC name is N-benzyl-2-(2,4,6-trichloroanilino)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(2,4,6-trichloroanilino)acetamide
PubChem CID28992616
Molecular FormulaC15H13Cl3N2O
Molecular Weight343.64 g/mol
Exact Mass342.01
IUPAC NameN-benzyl-2-(2,4,6-trichloroanilino)acetamide
SMILESO=C(CNc1c(Cl)cc(Cl)cc1Cl)NCc1ccccc1
InChIInChI=1S/C15H13Cl3N2O/c16-11-6-12(17)15(13(18)7-11)20-9-14(21)19-8-10-4-2-1-3-5-10/h1-7,20H,8-9H2,(H,19,21)
InChIKeyIQACVFHDUULYFN-UHFFFAOYSA-N
XLogP4.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.64
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-[(2,4-dichlorophenyl)methylamino]acetamide
CID 60647537
N-benzyl-2-(4-chloro-3-fluoroanilino)acetamide
CID 61062398
2-(2,4,6-trichloroanilino)acetic acid
CID 28992701
N-benzyl-3-(3,5-dichloroanilino)propanamide
CID 109018893
2-anilino-N-[(3-chloro-4-fluorophenyl)methyl]acetamide
CID 62538297
N-[2-(benzylamino)-2-oxoethyl]-3,4-dichlorobenzamide
CID 9336870
N-benzyl-2-hydrazinylacetamide
CID 15514349
N-benzyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815218
N-benzyl-2-[(4-chloro-1,2,5-thiadiazol-3-yl)amino]acetamide
CID 106193043
N-benzyl-2-[(3,5-dichlorophenyl)methyl-methylamino]acetamide
CID 52683480
2-(benzhydrylamino)-N-[(4-chlorophenyl)methyl]acetamide
CID 8545779
N-benzyl-2-[(4-bromo-3-chlorophenyl)methylamino]acetamide
CID 103581561

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2,4,6-trichloroanilino)acetamide?
The IUPAC name of N-benzyl-2-(2,4,6-trichloroanilino)acetamide (CID 28992616) is N-benzyl-2-(2,4,6-trichloroanilino)acetamide.
What is the SMILES notation for N-benzyl-2-(2,4,6-trichloroanilino)acetamide?
The canonical SMILES for N-benzyl-2-(2,4,6-trichloroanilino)acetamide is O=C(CNc1c(Cl)cc(Cl)cc1Cl)NCc1ccccc1.
What is the InChIKey of N-benzyl-2-(2,4,6-trichloroanilino)acetamide?
The InChIKey is IQACVFHDUULYFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl3N2O/c16-11-6-12(17)15(13(18)7-11)20-9-14(21)19-8-10-4-2-1-3-5-10/h1-7,20H,8-9H2,(H,19,21).
What are the key properties of N-benzyl-2-(2,4,6-trichloroanilino)acetamide?
N-benzyl-2-(2,4,6-trichloroanilino)acetamide has a molecular weight of 343.64 g/mol, XLogP of 4.38, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2,4,6-trichloroanilino)acetamide is sourced from PubChem (CID 28992616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).