(2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide

C17H16N2O3 — CID 7964267

IUPAC(2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(NC(=O)[C@@H](C)Oc2cccc(C#N)c2)c1
InChIInChI=1S/C17H16N2O3/c1-12(22-16-8-3-5-13(9-16)11-18)17(20)19-14-6-4-7-15(10-14)21-2/h3-10,12H,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyZUXGWSWQLMUUQQ-GFCCVEGCSA-N
MW296.33 g/mol
LogP2.97
Rot. Bonds5

About (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide

(2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide (PubChem CID 7964267) has the molecular formula C17H16N2O3 and a molecular weight of 296.33 g/mol. Its IUPAC name is (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide
PubChem CID7964267
Molecular FormulaC17H16N2O3
Molecular Weight296.33 g/mol
Exact Mass296.12
IUPAC Name(2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide
SMILESCOc1cccc(NC(=O)[C@@H](C)Oc2cccc(C#N)c2)c1
InChIInChI=1S/C17H16N2O3/c1-12(22-16-8-3-5-13(9-16)11-18)17(20)19-14-6-4-7-15(10-14)21-2/h3-10,12H,1-2H3,(H,19,20)/t12-/m1/s1
InChIKeyZUXGWSWQLMUUQQ-GFCCVEGCSA-N
XLogP2.97
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyanophenoxy)-N-(3-methoxyphenyl)propanamide
CID 51140373
(2R)-N-(3-cyanophenyl)-2-(3-iodophenoxy)propanamide
CID 7694555
2-(3-cyanophenoxy)-N-methylpropanamide
CID 43085589
(2S)-2-(3-cyanophenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 7964261
(2S)-2-(4-acetamidophenoxy)-N-(3-cyanophenyl)propanamide
CID 7642457
2-(4-acetamidophenoxy)-N-(3-methoxyphenyl)propanamide
CID 4884235
2-(4-acetylphenoxy)-N-(3-cyanophenyl)propanamide
CID 17450699
[(2S)-1-(3-cyanoanilino)-1-oxopropan-2-yl] 3,5-dimethoxybenzoate
CID 8509519
methyl N-[4-[2-(3-cyanophenoxy)propanoylamino]phenyl]-N-methylcarbamate
CID 47727905
(2S)-N-(3-cyanophenyl)-2-(2-fluorophenoxy)propanamide
CID 7815212
2-(2,6-dimethylphenoxy)-N-(3-methoxyphenyl)propanamide
CID 4958482
3-cyano-N-(3-methoxyphenyl)benzamide
CID 2709744

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide?
The IUPAC name of (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide (CID 7964267) is (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide?
The canonical SMILES for (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide is COc1cccc(NC(=O)[C@@H](C)Oc2cccc(C#N)c2)c1.
What is the InChIKey of (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide?
The InChIKey is ZUXGWSWQLMUUQQ-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H16N2O3/c1-12(22-16-8-3-5-13(9-16)11-18)17(20)19-14-6-4-7-15(10-14)21-2/h3-10,12H,1-2H3,(H,19,20)/t12-/m1/s1.
What are the key properties of (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide?
(2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide has a molecular weight of 296.33 g/mol, XLogP of 2.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3-cyanophenoxy)-N-(3-methoxyphenyl)propanamide is sourced from PubChem (CID 7964267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).