2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide

C14H11ClFNO2 — CID 39379903

IUPAC2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(Oc2cccc(F)c2)cc1
InChIInChI=1S/C14H11ClFNO2/c15-9-14(18)17-11-4-6-12(7-5-11)19-13-3-1-2-10(16)8-13/h1-8H,9H2,(H,17,18)
InChIKeyBUFAXSXDJUHRSG-UHFFFAOYSA-N
MW279.70 g/mol
LogP3.80
Rot. Bonds4

About 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide

2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide (PubChem CID 39379903) has the molecular formula C14H11ClFNO2 and a molecular weight of 279.70 g/mol. Its IUPAC name is 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide
PubChem CID39379903
Molecular FormulaC14H11ClFNO2
Molecular Weight279.70 g/mol
Exact Mass279.05
IUPAC Name2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide
SMILESO=C(CCl)Nc1ccc(Oc2cccc(F)c2)cc1
InChIInChI=1S/C14H11ClFNO2/c15-9-14(18)17-11-4-6-12(7-5-11)19-13-3-1-2-10(16)8-13/h1-8H,9H2,(H,17,18)
InChIKeyBUFAXSXDJUHRSG-UHFFFAOYSA-N
XLogP3.80
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.70
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-chloro-N-(3-fluorophenyl)acetamide
CID 2388931
2-(3-fluoroanilino)-N-(4-phenoxyphenyl)acetamide
CID 9098919
2-chloro-N-[4-(4-chlorophenoxy)phenyl]acetamide
CID 2782070
3-fluoro-N-[4-[3-[4-[(3-fluorobenzoyl)amino]phenoxy]phenoxy]phenyl]benzamide
CID 3108222
2-chloro-N-(4-fluorophenyl)acetamide
CID 532065
4-tert-butyl-N-[4-(3-fluorophenoxy)phenyl]benzamide
CID 142594929
N-[4-(3-fluorophenoxy)phenyl]-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 52706285
1,4-bis[3-(3-fluorophenoxy)phenoxy]benzene
CID 22338391
N-[4-(3-fluorophenoxy)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119299172
N-[4-(3-fluorophenoxy)phenyl]-2-imidazo[2,1-b][1,3]thiazol-6-ylacetamide
CID 60538380
2-(3-fluorophenoxy)-N-phenylacetamide
CID 2709732
2-phenoxy-N-[4-[3-[4-[(2-phenoxyacetyl)amino]phenoxy]phenoxy]phenyl]acetamide
CID 4227761

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide (CID 39379903) is 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide is O=C(CCl)Nc1ccc(Oc2cccc(F)c2)cc1.
What is the InChIKey of 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide?
The InChIKey is BUFAXSXDJUHRSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO2/c15-9-14(18)17-11-4-6-12(7-5-11)19-13-3-1-2-10(16)8-13/h1-8H,9H2,(H,17,18).
What are the key properties of 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide?
2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide has a molecular weight of 279.70 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(3-fluorophenoxy)phenyl]acetamide is sourced from PubChem (CID 39379903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).