2-chloro-N-(2,3-dichlorophenyl)acetamide

C8H6Cl3NO — CID 736953

IUPAC2-chloro-N-(2,3-dichlorophenyl)acetamide
SMILESO=C(CCl)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C8H6Cl3NO/c9-4-7(13)12-6-3-1-2-5(10)8(6)11/h1-3H,4H2,(H,12,13)
InChIKeyNBGQBIFGVDDWKO-UHFFFAOYSA-N
MW238.50 g/mol
LogP3.17
Rot. Bonds2

About 2-chloro-N-(2,3-dichlorophenyl)acetamide

2-chloro-N-(2,3-dichlorophenyl)acetamide (PubChem CID 736953) has the molecular formula C8H6Cl3NO and a molecular weight of 238.50 g/mol. Its IUPAC name is 2-chloro-N-(2,3-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-(2,3-dichlorophenyl)acetamide
PubChem CID736953
Molecular FormulaC8H6Cl3NO
Molecular Weight238.50 g/mol
Exact Mass236.95
IUPAC Name2-chloro-N-(2,3-dichlorophenyl)acetamide
SMILESO=C(CCl)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C8H6Cl3NO/c9-4-7(13)12-6-3-1-2-5(10)8(6)11/h1-3H,4H2,(H,12,13)
InChIKeyNBGQBIFGVDDWKO-UHFFFAOYSA-N
XLogP3.17
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.50
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2,3-dichlorophenyl)acetamide?
The IUPAC name of 2-chloro-N-(2,3-dichlorophenyl)acetamide (CID 736953) is 2-chloro-N-(2,3-dichlorophenyl)acetamide.
What is the SMILES notation for 2-chloro-N-(2,3-dichlorophenyl)acetamide?
The canonical SMILES for 2-chloro-N-(2,3-dichlorophenyl)acetamide is O=C(CCl)Nc1cccc(Cl)c1Cl.
What is the InChIKey of 2-chloro-N-(2,3-dichlorophenyl)acetamide?
The InChIKey is NBGQBIFGVDDWKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6Cl3NO/c9-4-7(13)12-6-3-1-2-5(10)8(6)11/h1-3H,4H2,(H,12,13).
What are the key properties of 2-chloro-N-(2,3-dichlorophenyl)acetamide?
2-chloro-N-(2,3-dichlorophenyl)acetamide has a molecular weight of 238.50 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2,3-dichlorophenyl)acetamide is sourced from PubChem (CID 736953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).