N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide

C15H13ClFNO2 — CID 31507595

IUPACN-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2cccc(Cl)c2F)cc1
InChIInChI=1S/C15H13ClFNO2/c1-10-5-7-11(8-6-10)20-9-14(19)18-13-4-2-3-12(16)15(13)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyIBDMELVZDBVXKD-UHFFFAOYSA-N
MW293.73 g/mol
LogP3.81
Rot. Bonds4

About N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide

N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide (PubChem CID 31507595) has the molecular formula C15H13ClFNO2 and a molecular weight of 293.73 g/mol. Its IUPAC name is N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide
PubChem CID31507595
Molecular FormulaC15H13ClFNO2
Molecular Weight293.73 g/mol
Exact Mass293.06
IUPAC NameN-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2cccc(Cl)c2F)cc1
InChIInChI=1S/C15H13ClFNO2/c1-10-5-7-11(8-6-10)20-9-14(19)18-13-4-2-3-12(16)15(13)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyIBDMELVZDBVXKD-UHFFFAOYSA-N
XLogP3.81
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.73
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-chloro-2-methylphenyl)-2-(4-methylphenoxy)acetamide
CID 759065
N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide
CID 26309229
2-[[2-(4-methylphenoxy)acetyl]amino]benzenethiolate
CID 135820587
2-(4-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 836156
N-(2-chloro-3-pyridinyl)-2-(4-methylphenoxy)acetamide
CID 823681
N-(3-chloro-2-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604948
2-(4-fluorophenoxy)-N-[2-(4-methylphenoxy)phenyl]acetamide
CID 24681386
N-(2,3-dichlorophenyl)-2-[4-(3,5-dimethylphenoxy)phenoxy]acetamide
CID 18870437
N-(3-acetamido-2-methylphenyl)-2-(3-chloro-4-fluorophenoxy)acetamide
CID 38228993
2,2,2-trifluoro-N-[2-[[2-(4-methylphenoxy)acetyl]amino]phenyl]acetamide
CID 108933509
N-(3-chloro-2-methylphenyl)-2-(3,5-dimethylphenoxy)acetamide
CID 679560
2-(4-chlorophenoxy)-N-[2-(4-methylphenoxy)phenyl]acetamide
CID 7925670

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide (CID 31507595) is N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide is Cc1ccc(OCC(=O)Nc2cccc(Cl)c2F)cc1.
What is the InChIKey of N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide?
The InChIKey is IBDMELVZDBVXKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClFNO2/c1-10-5-7-11(8-6-10)20-9-14(19)18-13-4-2-3-12(16)15(13)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide?
N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide has a molecular weight of 293.73 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-2-fluorophenyl)-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 31507595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).