(2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide

C19H20N2O3 — CID 5413283

IUPAC(2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCCOc1ccccc1NC(=O)[C@@H](C#N)Cc1ccc(OC)cc1
InChIInChI=1S/C19H20N2O3/c1-3-24-18-7-5-4-6-17(18)21-19(22)15(13-20)12-14-8-10-16(23-2)11-9-14/h4-11,15H,3,12H2,1-2H3,(H,21,22)/t15-/m1/s1
InChIKeyOWTXSLQXOFOTBT-OAHLLOKOSA-N
MW324.38 g/mol
LogP3.41
Rot. Bonds7

About (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide

(2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide (PubChem CID 5413283) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide
PubChem CID5413283
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name(2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCCOc1ccccc1NC(=O)[C@@H](C#N)Cc1ccc(OC)cc1
InChIInChI=1S/C19H20N2O3/c1-3-24-18-7-5-4-6-17(18)21-19(22)15(13-20)12-14-8-10-16(23-2)11-9-14/h4-11,15H,3,12H2,1-2H3,(H,21,22)/t15-/m1/s1
InChIKeyOWTXSLQXOFOTBT-OAHLLOKOSA-N
XLogP3.41
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-cyano-N-(2-methoxyphenyl)-3-(4-methylphenyl)propanamide
CID 763342
2-cyano-3-(4-methoxyphenyl)-N-phenylpropanamide
CID 15168845
2-cyano-N-(2-ethoxyphenyl)-3-(5-methylfuran-2-yl)propanamide
CID 73253951
2-cyano-N-(2-methoxyphenyl)-3-pyridin-4-ylpropanamide
CID 3169981
(2S)-2-cyano-N-(2-ethoxyphenyl)-3-thiophen-2-ylpropanamide
CID 863429
1-(2-ethoxyphenyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 971052
N'-(2-ethoxyphenyl)-N-[(4-methoxyphenyl)methyl]oxamide
CID 2273905
(2S)-2-cyano-N-(2-ethylphenyl)-3-(4-hydroxy-3-methoxyphenyl)propanamide
CID 7303724
(2R)-N-(2-ethoxyphenyl)-2-(4-methoxyphenyl)sulfanyl-2-phenylacetamide
CID 8907250
[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 4-methoxybenzoate
CID 7506876
N-(2-ethoxyphenyl)-2-[[5-[(4-methoxyphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide
CID 46622727
(2R)-2-(4-cyanophenoxy)-N-(2-ethoxyphenyl)-2-phenylacetamide
CID 7505945

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The IUPAC name of (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide (CID 5413283) is (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide is CCOc1ccccc1NC(=O)[C@@H](C#N)Cc1ccc(OC)cc1.
What is the InChIKey of (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The InChIKey is OWTXSLQXOFOTBT-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-3-24-18-7-5-4-6-17(18)21-19(22)15(13-20)12-14-8-10-16(23-2)11-9-14/h4-11,15H,3,12H2,1-2H3,(H,21,22)/t15-/m1/s1.
What are the key properties of (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide?
(2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide has a molecular weight of 324.38 g/mol, XLogP of 3.41, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyano-N-(2-ethoxyphenyl)-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 5413283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).