2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide

C13H19NO3 — CID 81387481

IUPAC2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
SMILESCCOCC(=O)N[C@H](C)c1ccccc1OC
InChIInChI=1S/C13H19NO3/c1-4-17-9-13(15)14-10(2)11-7-5-6-8-12(11)16-3/h5-8,10H,4,9H2,1-3H3,(H,14,15)/t10-/m1/s1
InChIKeyTXQRODUBNXRSMG-SNVBAGLBSA-N
MW237.30 g/mol
LogP1.91
Rot. Bonds6

About 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide

2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide (PubChem CID 81387481) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
PubChem CID81387481
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
SMILESCCOCC(=O)N[C@H](C)c1ccccc1OC
InChIInChI=1S/C13H19NO3/c1-4-17-9-13(15)14-10(2)11-7-5-6-8-12(11)16-3/h5-8,10H,4,9H2,1-3H3,(H,14,15)/t10-/m1/s1
InChIKeyTXQRODUBNXRSMG-SNVBAGLBSA-N
XLogP1.91
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R)-1-(2-bromophenyl)ethyl]-2-ethoxyacetamide
CID 81396707
2-(2-ethylphenoxy)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144695
2-(2-fluorophenoxy)-N-[(1S)-1-(2-methoxyphenyl)ethyl]acetamide
CID 7719194
3-(ethylamino)-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 62834607
[2-[1-(2-methoxyphenyl)ethylamino]-2-oxoethyl] 2-(2-methoxyphenoxy)acetate
CID 55366842
2-O-[2-[1-(2-methoxyphenyl)ethylamino]-2-oxoethyl] 1-O-methyl benzene-1,2-dicarboxylate
CID 56504459
2-(4-fluorophenoxy)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 51144558
3-(ethylamino)-N-[(1R)-1-(2-methoxyphenyl)ethyl]butanamide
CID 81387789
2-(2-tert-butylphenoxy)-N-[(1S)-1-(2-methoxyphenyl)ethyl]acetamide
CID 31183674
2-(4-chlorophenoxy)-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
CID 7719123
2-(3,5-dimethylphenoxy)-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide
CID 27787506
2-amino-N-[2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]-2-oxoethyl]acetamide
CID 81387632

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide (CID 81387481) is 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide is CCOCC(=O)N[C@H](C)c1ccccc1OC.
What is the InChIKey of 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide?
The InChIKey is TXQRODUBNXRSMG-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H19NO3/c1-4-17-9-13(15)14-10(2)11-7-5-6-8-12(11)16-3/h5-8,10H,4,9H2,1-3H3,(H,14,15)/t10-/m1/s1.
What are the key properties of 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide?
2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide has a molecular weight of 237.30 g/mol, XLogP of 1.91, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(1R)-1-(2-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 81387481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).