2-(5-cyano-2-methylphenoxy)-N-phenylacetamide

C16H14N2O2 — CID 103760055

IUPAC2-(5-cyano-2-methylphenoxy)-N-phenylacetamide
SMILESCc1ccc(C#N)cc1OCC(=O)Nc1ccccc1
InChIInChI=1S/C16H14N2O2/c1-12-7-8-13(10-17)9-15(12)20-11-16(19)18-14-5-3-2-4-6-14/h2-9H,11H2,1H3,(H,18,19)
InChIKeyRAVYBTOIQVUDJR-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.88
Rot. Bonds4

About 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide

2-(5-cyano-2-methylphenoxy)-N-phenylacetamide (PubChem CID 103760055) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide.

Molecular Properties

Compound Name2-(5-cyano-2-methylphenoxy)-N-phenylacetamide
PubChem CID103760055
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-(5-cyano-2-methylphenoxy)-N-phenylacetamide
SMILESCc1ccc(C#N)cc1OCC(=O)Nc1ccccc1
InChIInChI=1S/C16H14N2O2/c1-12-7-8-13(10-17)9-15(12)20-11-16(19)18-14-5-3-2-4-6-14/h2-9H,11H2,1H3,(H,18,19)
InChIKeyRAVYBTOIQVUDJR-UHFFFAOYSA-N
XLogP2.88
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyano-2,6-dimethylphenoxy)-N-phenylacetamide
CID 65471325
2-(5-cyano-2-methylphenoxy)acetohydrazide
CID 107661565
2-(4-bromo-2,5-dimethylphenoxy)-N-(3-cyanophenyl)acetamide
CID 4270480
N-(3-cyanophenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78769028
2-(5-cyano-2-methylphenoxy)-N-(cyclopropylmethyl)acetamide
CID 103760377
2-(4-cyanophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 8744068
2-(2,5-dimethylphenoxy)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 17123518
2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide
CID 2492527
2-(2-chloro-5-methylphenoxy)-N-(4-cyanophenyl)acetamide
CID 7642831
2-(5-cyano-2-methylphenoxy)-N-(1-methoxypropan-2-yl)acetamide
CID 103760436
N-(4-tert-butylphenyl)-2-(4-cyano-2-ethoxyphenoxy)acetamide
CID 7993191
5-[[2-(4-cyano-2-methoxyphenoxy)acetyl]amino]benzene-1,3-dicarboxamide
CID 41070274

Frequently Asked Questions

What is the IUPAC name of 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide?
The IUPAC name of 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide (CID 103760055) is 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide.
What is the SMILES notation for 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide?
The canonical SMILES for 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide is Cc1ccc(C#N)cc1OCC(=O)Nc1ccccc1.
What is the InChIKey of 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide?
The InChIKey is RAVYBTOIQVUDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-12-7-8-13(10-17)9-15(12)20-11-16(19)18-14-5-3-2-4-6-14/h2-9H,11H2,1H3,(H,18,19).
What are the key properties of 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide?
2-(5-cyano-2-methylphenoxy)-N-phenylacetamide has a molecular weight of 266.30 g/mol, XLogP of 2.88, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-cyano-2-methylphenoxy)-N-phenylacetamide is sourced from PubChem (CID 103760055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).