2-chloro-N-(4-fluorophenyl)acetamide

C8H7ClFNO — CID 532065

IUPAC2-chloro-N-(4-fluorophenyl)acetamide
SMILESO=C(CCl)Nc1ccc(F)cc1
InChIInChI=1S/C8H7ClFNO/c9-5-8(12)11-7-3-1-6(10)2-4-7/h1-4H,5H2,(H,11,12)
InChIKeyJDAWWCJBFPBHFL-UHFFFAOYSA-N
MW187.60 g/mol
LogP2.00
Rot. Bonds2

About 2-chloro-N-(4-fluorophenyl)acetamide

2-chloro-N-(4-fluorophenyl)acetamide (PubChem CID 532065) has the molecular formula C8H7ClFNO and a molecular weight of 187.60 g/mol. Its IUPAC name is 2-chloro-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-(4-fluorophenyl)acetamide
PubChem CID532065
Molecular FormulaC8H7ClFNO
Molecular Weight187.60 g/mol
Exact Mass187.02
IUPAC Name2-chloro-N-(4-fluorophenyl)acetamide
SMILESO=C(CCl)Nc1ccc(F)cc1
InChIInChI=1S/C8H7ClFNO/c9-5-8(12)11-7-3-1-6(10)2-4-7/h1-4H,5H2,(H,11,12)
InChIKeyJDAWWCJBFPBHFL-UHFFFAOYSA-N
XLogP2.00
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.60
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-chloroacetyl chloride;2-chloro-N-(4-fluorophenyl)acetamide
CID 161093004
2-chloro-N-[4-(4-fluorophenyl)sulfonylphenyl]acetamide
CID 3410124
N-(4-aminophenyl)-2-chloroacetamide
CID 17325387
N-(4-fluorophenyl)-3-hydroxypropanamide
CID 12748696
N'-(4-fluorophenyl)propanediamide
CID 18174009
2-chloro-N-(3-fluorophenyl)acetamide
CID 2388931
N'-(3,5-dichlorophenyl)-N-(4-fluorophenyl)propanediamide
CID 108954855
N-(4-chlorophenyl)-2-(4-fluorophenyl)acetamide
CID 7027780
2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide
CID 39379903
3-(3,5-dichloroanilino)-N-(4-fluorophenyl)propanamide
CID 109037696
N-(4-fluorophenyl)-2-(propylamino)acetamide
CID 28586343
2-chloro-N-[4-(1,1,2-trifluoroethyl)phenyl]acetamide
CID 166409220

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-chloro-N-(4-fluorophenyl)acetamide (CID 532065) is 2-chloro-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-chloro-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-chloro-N-(4-fluorophenyl)acetamide is O=C(CCl)Nc1ccc(F)cc1.
What is the InChIKey of 2-chloro-N-(4-fluorophenyl)acetamide?
The InChIKey is JDAWWCJBFPBHFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClFNO/c9-5-8(12)11-7-3-1-6(10)2-4-7/h1-4H,5H2,(H,11,12).
What are the key properties of 2-chloro-N-(4-fluorophenyl)acetamide?
2-chloro-N-(4-fluorophenyl)acetamide has a molecular weight of 187.60 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 532065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).