2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide

C16H13FN2O3 — CID 2492568

IUPAC2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide
SMILESCOc1cc(C#N)ccc1OCC(=O)Nc1ccccc1F
InChIInChI=1S/C16H13FN2O3/c1-21-15-8-11(9-18)6-7-14(15)22-10-16(20)19-13-5-3-2-4-12(13)17/h2-8H,10H2,1H3,(H,19,20)
InChIKeyZAGWTKOQODYONC-UHFFFAOYSA-N
MW300.29 g/mol
LogP2.72
Rot. Bonds5

About 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide

2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide (PubChem CID 2492568) has the molecular formula C16H13FN2O3 and a molecular weight of 300.29 g/mol. Its IUPAC name is 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide
PubChem CID2492568
Molecular FormulaC16H13FN2O3
Molecular Weight300.29 g/mol
Exact Mass300.09
IUPAC Name2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide
SMILESCOc1cc(C#N)ccc1OCC(=O)Nc1ccccc1F
InChIInChI=1S/C16H13FN2O3/c1-21-15-8-11(9-18)6-7-14(15)22-10-16(20)19-13-5-3-2-4-12(13)17/h2-8H,10H2,1H3,(H,19,20)
InChIKeyZAGWTKOQODYONC-UHFFFAOYSA-N
XLogP2.72
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.29
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyano-2-fluorophenoxy)-N-(2-fluorophenyl)acetamide
CID 103793510
2-(4-cyano-2-methoxyphenoxy)-N-(2-propan-2-ylphenyl)acetamide
CID 7757492
2-(4-cyano-2-methoxyphenoxy)-N-(4-methoxy-2,5-dimethylphenyl)acetamide
CID 2976145
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-(4-cyano-2-methoxyphenoxy)acetamide
CID 16511735
N-(2-chlorophenyl)-2-(4-cyano-2-fluorophenoxy)acetamide
CID 103792209
N-(2-chloro-4-methylphenyl)-2-(4-cyano-2-methoxyphenoxy)acetamide
CID 7252194
2-(4-cyano-2-ethoxyphenoxy)-N-(2,5-difluorophenyl)acetamide
CID 7992848
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(4-cyano-2-methoxyphenoxy)acetamide
CID 7252185
2-(4-cyano-2-methoxyphenoxy)-N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]acetamide
CID 55378667
2-cyano-3-[4-[2-(2-fluoroanilino)-2-oxoethoxy]-3-methoxyphenyl]-N-phenylprop-2-enamide
CID 3929011
2-(4-cyano-2-methoxyphenoxy)-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 7757339
4-[2-(2-fluoroanilino)-2-oxoethoxy]-3,5-dimethoxybenzoic acid
CID 99989728

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide (CID 2492568) is 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide is COc1cc(C#N)ccc1OCC(=O)Nc1ccccc1F.
What is the InChIKey of 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
The InChIKey is ZAGWTKOQODYONC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O3/c1-21-15-8-11(9-18)6-7-14(15)22-10-16(20)19-13-5-3-2-4-12(13)17/h2-8H,10H2,1H3,(H,19,20).
What are the key properties of 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide?
2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide has a molecular weight of 300.29 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyano-2-methoxyphenoxy)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 2492568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).