(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide

C14H20N2O4 — CID 8750931

IUPAC(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide
SMILESCCNC(=O)[C@H](C)NC(=O)COc1ccccc1OC
InChIInChI=1S/C14H20N2O4/c1-4-15-14(18)10(2)16-13(17)9-20-12-8-6-5-7-11(12)19-3/h5-8,10H,4,9H2,1-3H3,(H,15,18)(H,16,17)/t10-/m0/s1
InChIKeyRNRCFZMEYRGQND-JTQLQIEISA-N
MW280.32 g/mol
LogP0.71
Rot. Bonds7

About (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide

(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide (PubChem CID 8750931) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide.

Molecular Properties

Compound Name(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide
PubChem CID8750931
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide
SMILESCCNC(=O)[C@H](C)NC(=O)COc1ccccc1OC
InChIInChI=1S/C14H20N2O4/c1-4-15-14(18)10(2)16-13(17)9-20-12-8-6-5-7-11(12)19-3/h5-8,10H,4,9H2,1-3H3,(H,15,18)(H,16,17)/t10-/m0/s1
InChIKeyRNRCFZMEYRGQND-JTQLQIEISA-N
XLogP0.71
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (2R)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoate
CID 113257879
2-[[2-[2-(aminomethyl)phenoxy]acetyl]amino]-N-ethylpropanamide
CID 43575741
(2R)-N-ethyl-2-[[2-(2-methoxyphenyl)acetyl]amino]propanamide
CID 8751746
(2S)-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanoic acid
CID 746811
(2S)-N-ethyl-2-[[2-(2-methoxy-5-nitrophenoxy)acetyl]amino]propanamide
CID 8566597
(2S)-N-ethyl-2-[[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]amino]propanamide
CID 8751619
2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-N-ethylpropanamide
CID 47112988
2-(2-methoxyphenoxy)-N-pentan-2-ylacetamide
CID 2957379
[2-[[(2R)-1-(ethylamino)-1-oxopropan-2-yl]amino]-2-oxoethyl] 2-[(2-methoxybenzoyl)amino]acetate
CID 8842013
N-[(2R)-1-hydroxypropan-2-yl]-2-(2-methoxyphenoxy)acetamide
CID 39086763
[2-[[(2R)-1-(ethylamino)-1-oxopropan-2-yl]amino]-2-oxoethyl] 2-(2-formylphenoxy)acetate
CID 9197744
2-(2-methoxyphenoxy)-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]acetamide
CID 110347464

Frequently Asked Questions

What is the IUPAC name of (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide?
The IUPAC name of (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide (CID 8750931) is (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide.
What is the SMILES notation for (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide?
The canonical SMILES for (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide is CCNC(=O)[C@H](C)NC(=O)COc1ccccc1OC.
What is the InChIKey of (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide?
The InChIKey is RNRCFZMEYRGQND-JTQLQIEISA-N. The full InChI is InChI=1S/C14H20N2O4/c1-4-15-14(18)10(2)16-13(17)9-20-12-8-6-5-7-11(12)19-3/h5-8,10H,4,9H2,1-3H3,(H,15,18)(H,16,17)/t10-/m0/s1.
What are the key properties of (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide?
(2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide has a molecular weight of 280.32 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-ethyl-2-[[2-(2-methoxyphenoxy)acetyl]amino]propanamide is sourced from PubChem (CID 8750931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).