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

C15H11IN2O2 — CID 2565297

IUPAC2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide
SMILESN#Cc1ccccc1OCC(=O)Nc1cccc(I)c1
InChIInChI=1S/C15H11IN2O2/c16-12-5-3-6-13(8-12)18-15(19)10-20-14-7-2-1-4-11(14)9-17/h1-8H,10H2,(H,18,19)
InChIKeyRAGQPBXYVAJNIU-UHFFFAOYSA-N
MW378.17 g/mol
LogP3.18
Rot. Bonds4

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

2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide (PubChem CID 2565297) has the molecular formula C15H11IN2O2 and a molecular weight of 378.17 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide
PubChem CID2565297
Molecular FormulaC15H11IN2O2
Molecular Weight378.17 g/mol
Exact Mass377.99
IUPAC Name2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide
SMILESN#Cc1ccccc1OCC(=O)Nc1cccc(I)c1
InChIInChI=1S/C15H11IN2O2/c16-12-5-3-6-13(8-12)18-15(19)10-20-14-7-2-1-4-11(14)9-17/h1-8H,10H2,(H,18,19)
InChIKeyRAGQPBXYVAJNIU-UHFFFAOYSA-N
XLogP3.18
TPSA62.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.17
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-[[2-(2-cyanophenoxy)acetyl]amino]benzamide
CID 78779251
2-(2-cyanophenoxy)-N-(3-iodo-4-methylphenyl)acetamide
CID 8874271
2-(2-cyanophenoxy)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18231496
2-(2-cyanophenoxy)-N-(4-fluoro-3-methylphenyl)acetamide
CID 62812512
methyl 3-[2-[3-[[2-(2-cyanophenoxy)acetyl]amino]phenyl]ethynyl]benzoate
CID 18204444
N-(3-bromo-4-methylphenyl)-2-(2-cyanophenoxy)acetamide
CID 7382555
2-(2-cyanophenoxy)-N-(2,6-difluorophenyl)acetamide
CID 2565570
2-(2-cyanophenoxy)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 30859534
N-(3-cyanophenyl)-2-(2-hydroxyphenoxy)acetamide
CID 78769028
[2-(3-iodoanilino)-2-oxoethyl] 2-(2-chlorophenoxy)acetate
CID 41465436
4-[2-(3-iodoanilino)-2-oxoethoxy]benzoic acid
CID 43214190
2-(2-cyanophenoxy)-N-[4-(2-methoxyphenoxy)phenyl]acetamide
CID 27901734

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide (CID 2565297) is 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide is N#Cc1ccccc1OCC(=O)Nc1cccc(I)c1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide?
The InChIKey is RAGQPBXYVAJNIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11IN2O2/c16-12-5-3-6-13(8-12)18-15(19)10-20-14-7-2-1-4-11(14)9-17/h1-8H,10H2,(H,18,19).
What are the key properties of 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide?
2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide has a molecular weight of 378.17 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-(3-iodophenyl)acetamide is sourced from PubChem (CID 2565297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).