N-benzyl-2-(3-cyanophenoxy)acetamide

C16H14N2O2 — CID 2591402

IUPACN-benzyl-2-(3-cyanophenoxy)acetamide
SMILESN#Cc1cccc(OCC(=O)NCc2ccccc2)c1
InChIInChI=1S/C16H14N2O2/c17-10-14-7-4-8-15(9-14)20-12-16(19)18-11-13-5-2-1-3-6-13/h1-9H,11-12H2,(H,18,19)
InChIKeyVSBAXAPHTGGQPS-UHFFFAOYSA-N
MW266.30 g/mol
LogP2.25
Rot. Bonds5

About N-benzyl-2-(3-cyanophenoxy)acetamide

N-benzyl-2-(3-cyanophenoxy)acetamide (PubChem CID 2591402) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is N-benzyl-2-(3-cyanophenoxy)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(3-cyanophenoxy)acetamide
PubChem CID2591402
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC NameN-benzyl-2-(3-cyanophenoxy)acetamide
SMILESN#Cc1cccc(OCC(=O)NCc2ccccc2)c1
InChIInChI=1S/C16H14N2O2/c17-10-14-7-4-8-15(9-14)20-12-16(19)18-11-13-5-2-1-3-6-13/h1-9H,11-12H2,(H,18,19)
InChIKeyVSBAXAPHTGGQPS-UHFFFAOYSA-N
XLogP2.25
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-chlorophenyl)methyl]-2-(3-cyanophenoxy)acetamide
CID 7963971
2-(4-aminophenoxy)-N-[(3-cyanophenyl)methyl]acetamide
CID 61103319
N-benzyl-2-(3-ethoxyphenoxy)acetamide
CID 112977703
2-(3-cyanophenoxy)-N-prop-2-enylacetamide
CID 24699881
N-benzyl-3-[2-(4-cyanoanilino)-2-oxoethoxy]benzamide
CID 9253189
N-[(3-bromophenyl)methyl]-2-(4-cyanophenoxy)acetamide
CID 60739831
N-[(3-chlorophenyl)methyl]-2-(4-cyanophenoxy)acetamide
CID 2710123
2-(3-cyanophenoxy)-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 9457314
N-[(4-cyanophenyl)methyl]-2-phenylmethoxyacetamide
CID 134035388
2-(4-cyanophenoxy)-N-[(4-methylphenyl)methyl]acetamide
CID 8781293
N-benzyl-3-[(4-cyanophenyl)methoxy]benzamide
CID 7492266
N-benzyl-2-(3-cyanophenoxy)-N-ethylacetamide
CID 7964477

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(3-cyanophenoxy)acetamide?
The IUPAC name of N-benzyl-2-(3-cyanophenoxy)acetamide (CID 2591402) is N-benzyl-2-(3-cyanophenoxy)acetamide.
What is the SMILES notation for N-benzyl-2-(3-cyanophenoxy)acetamide?
The canonical SMILES for N-benzyl-2-(3-cyanophenoxy)acetamide is N#Cc1cccc(OCC(=O)NCc2ccccc2)c1.
What is the InChIKey of N-benzyl-2-(3-cyanophenoxy)acetamide?
The InChIKey is VSBAXAPHTGGQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c17-10-14-7-4-8-15(9-14)20-12-16(19)18-11-13-5-2-1-3-6-13/h1-9H,11-12H2,(H,18,19).
What are the key properties of N-benzyl-2-(3-cyanophenoxy)acetamide?
N-benzyl-2-(3-cyanophenoxy)acetamide has a molecular weight of 266.30 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(3-cyanophenoxy)acetamide is sourced from PubChem (CID 2591402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).