2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide

C19H20N2O3 — CID 51156822

IUPAC2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide
SMILESCC(Oc1ccc(C#N)cc1)C(=O)N(C)CCOc1ccccc1
InChIInChI=1S/C19H20N2O3/c1-15(24-18-10-8-16(14-20)9-11-18)19(22)21(2)12-13-23-17-6-4-3-5-7-17/h3-11,15H,12-13H2,1-2H3
InChIKeyHVIKPCAKDMNNTK-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.86
Rot. Bonds7

About 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide

2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide (PubChem CID 51156822) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide
PubChem CID51156822
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide
SMILESCC(Oc1ccc(C#N)cc1)C(=O)N(C)CCOc1ccccc1
InChIInChI=1S/C19H20N2O3/c1-15(24-18-10-8-16(14-20)9-11-18)19(22)21(2)12-13-23-17-6-4-3-5-7-17/h3-11,15H,12-13H2,1-2H3
InChIKeyHVIKPCAKDMNNTK-UHFFFAOYSA-N
XLogP2.86
TPSA62.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-cyanophenoxy)propanoyl-methylamino]acetic acid
CID 43092177
(2R)-2-(4-cyanophenoxy)-N-methyl-N-phenylpropanamide
CID 40566840
2-(4-cyanophenoxy)-N,N-dimethylpropanamide
CID 17400502
(2S)-2-(4-cyanophenoxy)propanoic acid
CID 7127729
2-(4-cyanophenoxy)-N-[(4-methoxyphenyl)methyl]-N-methylpropanamide
CID 51155118
2-(4-cyanophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)propanamide
CID 51158213
2-(4-cyanophenoxy)-N,N-diethylpropanamide
CID 43083146
(2S)-N-[2-(3-cyanophenoxy)ethyl]-2-hydroxy-N-methyl-2-phenylacetamide
CID 95908666
N-(4-cyanophenyl)-2-[methyl(2-phenoxyethyl)amino]propanamide
CID 17437572
2-(4-cyanophenoxy)-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 51144723
N-[(3-cyanophenyl)methyl]-N-methyl-2-(4-phenylphenoxy)propanamide
CID 55609402
4-[phenoxy-[4-(phenoxymethoxy)phenoxy]methoxy]benzonitrile
CID 130209313

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide (CID 51156822) is 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide is CC(Oc1ccc(C#N)cc1)C(=O)N(C)CCOc1ccccc1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide?
The InChIKey is HVIKPCAKDMNNTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c1-15(24-18-10-8-16(14-20)9-11-18)19(22)21(2)12-13-23-17-6-4-3-5-7-17/h3-11,15H,12-13H2,1-2H3.
What are the key properties of 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide?
2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide has a molecular weight of 324.38 g/mol, XLogP of 2.86, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-methyl-N-(2-phenoxyethyl)propanamide is sourced from PubChem (CID 51156822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).