2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide

C22H26N2O5 — CID 110347257

IUPAC2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide
SMILESCOc1ccccc1OCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1
InChIInChI=1S/C22H26N2O5/c1-27-19-9-5-6-10-20(19)29-16-21(25)23-18(15-17-7-3-2-4-8-17)22(26)24-11-13-28-14-12-24/h2-10,18H,11-16H2,1H3,(H,23,25)/t18-/m0/s1
InChIKeyQOHJCXOMHCWZAT-SFHVURJKSA-N
MW398.46 g/mol
LogP1.66
Rot. Bonds8

About 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide

2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide (PubChem CID 110347257) has the molecular formula C22H26N2O5 and a molecular weight of 398.46 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide
PubChem CID110347257
Molecular FormulaC22H26N2O5
Molecular Weight398.46 g/mol
Exact Mass398.18
IUPAC Name2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide
SMILESCOc1ccccc1OCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1
InChIInChI=1S/C22H26N2O5/c1-27-19-9-5-6-10-20(19)29-16-21(25)23-18(15-17-7-3-2-4-8-17)22(26)24-11-13-28-14-12-24/h2-10,18H,11-16H2,1H3,(H,23,25)/t18-/m0/s1
InChIKeyQOHJCXOMHCWZAT-SFHVURJKSA-N
XLogP1.66
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide (CID 110347257) is 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide is COc1ccccc1OCC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide?
The InChIKey is QOHJCXOMHCWZAT-SFHVURJKSA-N. The full InChI is InChI=1S/C22H26N2O5/c1-27-19-9-5-6-10-20(19)29-16-21(25)23-18(15-17-7-3-2-4-8-17)22(26)24-11-13-28-14-12-24/h2-10,18H,11-16H2,1H3,(H,23,25)/t18-/m0/s1.
What are the key properties of 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide?
2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide has a molecular weight of 398.46 g/mol, XLogP of 1.66, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-[(2S)-1-morpholin-4-yl-1-oxo-3-phenylpropan-2-yl]acetamide is sourced from PubChem (CID 110347257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).