(2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide

C18H21NO3 — CID 94184628

IUPAC(2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide
SMILESCCOc1cccc(CNC(=O)[C@@H](C)Oc2ccccc2)c1
InChIInChI=1S/C18H21NO3/c1-3-21-17-11-7-8-15(12-17)13-19-18(20)14(2)22-16-9-5-4-6-10-16/h4-12,14H,3,13H2,1-2H3,(H,19,20)/t14-/m1/s1
InChIKeyFWPDQVGLIHRNNF-CQSZACIVSA-N
MW299.37 g/mol
LogP3.17
Rot. Bonds7

About (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide

(2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide (PubChem CID 94184628) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide.

Molecular Properties

Compound Name(2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide
PubChem CID94184628
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name(2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide
SMILESCCOc1cccc(CNC(=O)[C@@H](C)Oc2ccccc2)c1
InChIInChI=1S/C18H21NO3/c1-3-21-17-11-7-8-15(12-17)13-19-18(20)14(2)22-16-9-5-4-6-10-16/h4-12,14H,3,13H2,1-2H3,(H,19,20)/t14-/m1/s1
InChIKeyFWPDQVGLIHRNNF-CQSZACIVSA-N
XLogP3.17
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-[(3-ethoxyphenyl)methyl]-2-(4-fluorophenoxy)propanamide
CID 28567347
N-[(3-ethoxyphenyl)methyl]-2-(2-ethylphenoxy)propanamide
CID 46770916
4-[(3-ethoxyphenyl)methylamino]-2,3-dimethyl-4-oxobutanoic acid
CID 103496650
(2S)-N-[(3-methylphenyl)methyl]-2-phenoxypropanamide
CID 38295049
N-[(3-ethoxyphenyl)methyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133235704
(2S)-2-(2,3-dimethylphenoxy)-N-[(3-ethoxyphenyl)methyl]propanamide
CID 99131504
N-benzyl-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388625
(2S)-2-(2,4-dimethylphenoxy)-N-[(3-ethoxyphenyl)methyl]propanamide
CID 99132247
(2S)-N-[(3-ethoxyphenyl)methyl]-2-phenylsulfanylpropanamide
CID 92675328
3-amino-N-[(3-ethoxyphenyl)methyl]-2-methylpropanamide
CID 62671028
(2S)-2-naphthalen-2-yloxy-N-[(3-propan-2-yloxyphenyl)methyl]propanamide
CID 99131030
(2R)-N-[(3-ethoxyphenyl)methyl]-2-(4-ethylphenoxy)butanamide
CID 99133064

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide?
The IUPAC name of (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide (CID 94184628) is (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide.
What is the SMILES notation for (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide?
The canonical SMILES for (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide is CCOc1cccc(CNC(=O)[C@@H](C)Oc2ccccc2)c1.
What is the InChIKey of (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide?
The InChIKey is FWPDQVGLIHRNNF-CQSZACIVSA-N. The full InChI is InChI=1S/C18H21NO3/c1-3-21-17-11-7-8-15(12-17)13-19-18(20)14(2)22-16-9-5-4-6-10-16/h4-12,14H,3,13H2,1-2H3,(H,19,20)/t14-/m1/s1.
What are the key properties of (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide?
(2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide has a molecular weight of 299.37 g/mol, XLogP of 3.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[(3-ethoxyphenyl)methyl]-2-phenoxypropanamide is sourced from PubChem (CID 94184628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).