[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate

C19H27N3O6 — CID 8573927

IUPAC[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
SMILESCCN(CC)C(=O)CN(C)C(=O)COC(=O)CNC(=O)c1cccc(OC)c1
InChIInChI=1S/C19H27N3O6/c1-5-22(6-2)16(23)12-21(3)17(24)13-28-18(25)11-20-19(26)14-8-7-9-15(10-14)27-4/h7-10H,5-6,11-13H2,1-4H3,(H,20,26)
InChIKeyDGYNXEURIATGAM-UHFFFAOYSA-N
MW393.44 g/mol
LogP0.29
Rot. Bonds10

About [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate

[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate (PubChem CID 8573927) has the molecular formula C19H27N3O6 and a molecular weight of 393.44 g/mol. Its IUPAC name is [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate.

Molecular Properties

Compound Name[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
PubChem CID8573927
Molecular FormulaC19H27N3O6
Molecular Weight393.44 g/mol
Exact Mass393.19
IUPAC Name[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
SMILESCCN(CC)C(=O)CN(C)C(=O)COC(=O)CNC(=O)c1cccc(OC)c1
InChIInChI=1S/C19H27N3O6/c1-5-22(6-2)16(23)12-21(3)17(24)13-28-18(25)11-20-19(26)14-8-7-9-15(10-14)27-4/h7-10H,5-6,11-13H2,1-4H3,(H,20,26)
InChIKeyDGYNXEURIATGAM-UHFFFAOYSA-N
XLogP0.29
TPSA105.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.44
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate with MolForge

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Related Compounds

phenacyl 2-[(3-methoxybenzoyl)amino]acetate
CID 2165686
[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(2-naphthalen-1-ylacetyl)amino]acetate
CID 9070919
[2-oxo-2-[[2-oxo-2-(propylamino)ethyl]amino]ethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 8573952
[2-[[(2S)-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 7881991
[2-[3-chloro-N-(2-cyanoethyl)anilino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 41215375
2-[3-[[2-(diethylamino)-2-oxoethyl]-methylcarbamoyl]phenoxy]acetic acid
CID 119179589
[2-[(4-methoxyphenyl)carbamoylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 31145131
[2-(2-carbamoylanilino)-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 7899308
[2-(3,4-dimethylanilino)-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 7882526
[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate
CID 8521806
ethyl 4-[2-[2-[(3-methoxybenzoyl)amino]acetyl]oxyacetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate
CID 41448128
(4-fluorophenyl)methyl 2-[(3-methoxybenzoyl)amino]acetate
CID 7899297

Frequently Asked Questions

What is the IUPAC name of [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate?
The IUPAC name of [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate (CID 8573927) is [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate.
What is the SMILES notation for [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate?
The canonical SMILES for [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate is CCN(CC)C(=O)CN(C)C(=O)COC(=O)CNC(=O)c1cccc(OC)c1.
What is the InChIKey of [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate?
The InChIKey is DGYNXEURIATGAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O6/c1-5-22(6-2)16(23)12-21(3)17(24)13-28-18(25)11-20-19(26)14-8-7-9-15(10-14)27-4/h7-10H,5-6,11-13H2,1-4H3,(H,20,26).
What are the key properties of [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate?
[2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate has a molecular weight of 393.44 g/mol, XLogP of 0.29, 10 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-(diethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl] 2-[(3-methoxybenzoyl)amino]acetate is sourced from PubChem (CID 8573927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).