N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide

C15H13Cl3N2O — CID 33162844

IUPACN-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
SMILESCc1c(Cl)cccc1NC(=O)CNc1cccc(Cl)c1Cl
InChIInChI=1S/C15H13Cl3N2O/c1-9-10(16)4-2-6-12(9)20-14(21)8-19-13-7-3-5-11(17)15(13)18/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyGUPJORZDGLHWCW-UHFFFAOYSA-N
MW343.64 g/mol
LogP5.01
Rot. Bonds4

About N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide

N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide (PubChem CID 33162844) has the molecular formula C15H13Cl3N2O and a molecular weight of 343.64 g/mol. Its IUPAC name is N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
PubChem CID33162844
Molecular FormulaC15H13Cl3N2O
Molecular Weight343.64 g/mol
Exact Mass342.01
IUPAC NameN-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
SMILESCc1c(Cl)cccc1NC(=O)CNc1cccc(Cl)c1Cl
InChIInChI=1S/C15H13Cl3N2O/c1-9-10(16)4-2-6-12(9)20-14(21)8-19-13-7-3-5-11(17)15(13)18/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyGUPJORZDGLHWCW-UHFFFAOYSA-N
XLogP5.01
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.64
LogP ≤ 55.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[[2-(3-chloro-2-methylanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54814911
N-[3-[[2-(2,3-dichloroanilino)acetyl]amino]-2-methylphenyl]cyclopropanecarboxamide
CID 54815961
N-(3-chloro-2-methylphenyl)-2-(2-fluoroanilino)acetamide
CID 2604427
N-(4-acetamidophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54816111
N,N'-bis(3-chloro-2-methylphenyl)butanediamide
CID 1226548
2-(5-chloro-2-methylanilino)-N-(3-chloro-2-methylphenyl)acetamide
CID 2541105
2-(3-chloro-2-methylanilino)-N-(2-fluorophenyl)acetamide
CID 9099260
N-(3-chloro-2-methylphenyl)-2-(2-ethoxyanilino)acetamide
CID 9101959
2-(2-chloroanilino)-N-(2,3-dimethylphenyl)acetamide
CID 9098705
N-(4-chlorophenyl)-2-(2,3-dichloroanilino)acetamide
CID 29039257
N-(2-tert-butylphenyl)-2-(3-chloro-2-methylanilino)acetamide
CID 109008221
2-(2,3-dichloroanilino)-N-(2,4,6-trimethylphenyl)acetamide
CID 42069816

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide?
The IUPAC name of N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide (CID 33162844) is N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide.
What is the SMILES notation for N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide?
The canonical SMILES for N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide is Cc1c(Cl)cccc1NC(=O)CNc1cccc(Cl)c1Cl.
What is the InChIKey of N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide?
The InChIKey is GUPJORZDGLHWCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl3N2O/c1-9-10(16)4-2-6-12(9)20-14(21)8-19-13-7-3-5-11(17)15(13)18/h2-7,19H,8H2,1H3,(H,20,21).
What are the key properties of N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide?
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide has a molecular weight of 343.64 g/mol, XLogP of 5.01, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide is sourced from PubChem (CID 33162844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).