2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide

C22H26N2O5 — CID 131942322

IUPAC2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)c1C
InChIInChI=1S/C22H26N2O5/c1-16-4-3-5-20(17(16)2)29-14-21(25)23-18-6-8-19(9-7-18)28-15-22(26)24-10-12-27-13-11-24/h3-9H,10-15H2,1-2H3,(H,23,25)
InChIKeyRZCQKOJHGBXMJY-UHFFFAOYSA-N
MW398.46 g/mol
LogP2.56
Rot. Bonds7

About 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide

2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide (PubChem CID 131942322) has the molecular formula C22H26N2O5 and a molecular weight of 398.46 g/mol. Its IUPAC name is 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
PubChem CID131942322
Molecular FormulaC22H26N2O5
Molecular Weight398.46 g/mol
Exact Mass398.18
IUPAC Name2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
SMILESCc1cccc(OCC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)c1C
InChIInChI=1S/C22H26N2O5/c1-16-4-3-5-20(17(16)2)29-14-21(25)23-18-6-8-19(9-7-18)28-15-22(26)24-10-12-27-13-11-24/h3-9H,10-15H2,1-2H3,(H,23,25)
InChIKeyRZCQKOJHGBXMJY-UHFFFAOYSA-N
XLogP2.56
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.46
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide
CID 7203468
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide;hydrate
CID 139069446
2-(2,3-dimethylphenoxy)-N-(4-methoxyphenyl)acetamide
CID 720608
methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
CID 2923381
4-[[2-(2,3-dimethylphenoxy)acetyl]amino]benzoic acid
CID 19172685
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]benzamide
CID 9252709
2-(2,3-dimethylphenoxy)-1-[4-[2-(2,3-dimethylphenoxy)acetyl]-1,4-diazepan-1-yl]ethanone
CID 108546513
2-(4-methylphenoxy)-1-morpholin-4-ylethanone
CID 674914
2-(2,3-dimethylphenoxy)-N-[4-(phenylcarbamoylamino)phenyl]acetamide
CID 18164294
1-[4-[2-(2,3-dimethylphenoxy)acetyl]piperazin-1-yl]propan-1-one
CID 108535733
2-(2,3-dimethylphenoxy)-N-[4-(3-phenylpropoxy)phenyl]acetamide
CID 17130266
N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-2-pyridin-3-ylacetamide
CID 131931518

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide?
The IUPAC name of 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide (CID 131942322) is 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide is Cc1cccc(OCC(=O)Nc2ccc(OCC(=O)N3CCOCC3)cc2)c1C.
What is the InChIKey of 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide?
The InChIKey is RZCQKOJHGBXMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O5/c1-16-4-3-5-20(17(16)2)29-14-21(25)23-18-6-8-19(9-7-18)28-15-22(26)24-10-12-27-13-11-24/h3-9H,10-15H2,1-2H3,(H,23,25).
What are the key properties of 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide?
2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide has a molecular weight of 398.46 g/mol, XLogP of 2.56, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylphenoxy)-N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]acetamide is sourced from PubChem (CID 131942322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).