3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide

C22H36N2O4 — CID 46539482

IUPAC3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide
SMILESCCC(CC)C(CNC(=O)CCc1cc(OC)ccc1OC)N1CCOCC1
InChIInChI=1S/C22H36N2O4/c1-5-17(6-2)20(24-11-13-28-14-12-24)16-23-22(25)10-7-18-15-19(26-3)8-9-21(18)27-4/h8-9,15,17,20H,5-7,10-14,16H2,1-4H3,(H,23,25)
InChIKeyCYZDQDKRVNEJGQ-UHFFFAOYSA-N
MW392.54 g/mol
LogP2.89
Rot. Bonds11

About 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide

3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide (PubChem CID 46539482) has the molecular formula C22H36N2O4 and a molecular weight of 392.54 g/mol. Its IUPAC name is 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide.

Molecular Properties

Compound Name3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide
PubChem CID46539482
Molecular FormulaC22H36N2O4
Molecular Weight392.54 g/mol
Exact Mass392.27
IUPAC Name3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide
SMILESCCC(CC)C(CNC(=O)CCc1cc(OC)ccc1OC)N1CCOCC1
InChIInChI=1S/C22H36N2O4/c1-5-17(6-2)20(24-11-13-28-14-12-24)16-23-22(25)10-7-18-15-19(26-3)8-9-21(18)27-4/h8-9,15,17,20H,5-7,10-14,16H2,1-4H3,(H,23,25)
InChIKeyCYZDQDKRVNEJGQ-UHFFFAOYSA-N
XLogP2.89
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.54
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(4-methoxyphenyl)propanamide
CID 75691751
N-(3-ethyl-2-morpholin-4-ylpentyl)-2-(3-methoxy-4-methylphenyl)acetamide
CID 55548898
3-(2,5-dimethoxyphenyl)-N-[(2R)-2-(ethylamino)propyl]propanamide
CID 120650953
3-(2,5-dimethoxyphenyl)-N-(2-hydroxypropyl)propanamide
CID 78855932
N-(3-ethyl-2-morpholin-4-ylpentyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 42943249
(2S)-N-[(2S)-3-ethyl-2-morpholin-4-ylpentyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 25495550
1-(3-ethyl-2-morpholin-4-ylpentyl)-3-(2-methoxyphenyl)urea
CID 24665000
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-thiophen-3-ylpropanamide
CID 134053099
4-(difluoromethoxy)-N-(3-ethyl-2-morpholin-4-ylpentyl)-3-methoxybenzamide
CID 43046344
N-(3-ethyl-2-morpholin-4-ylpentyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 43049020
N-(3-ethyl-2-morpholin-4-ylpentyl)-4-(methylamino)butanamide;dihydrochloride
CID 119841667
2-(3-bromo-4-fluorophenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)acetamide
CID 60524780

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide?
The IUPAC name of 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide (CID 46539482) is 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide.
What is the SMILES notation for 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide?
The canonical SMILES for 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide is CCC(CC)C(CNC(=O)CCc1cc(OC)ccc1OC)N1CCOCC1.
What is the InChIKey of 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide?
The InChIKey is CYZDQDKRVNEJGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H36N2O4/c1-5-17(6-2)20(24-11-13-28-14-12-24)16-23-22(25)10-7-18-15-19(26-3)8-9-21(18)27-4/h8-9,15,17,20H,5-7,10-14,16H2,1-4H3,(H,23,25).
What are the key properties of 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide?
3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide has a molecular weight of 392.54 g/mol, XLogP of 2.89, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethoxyphenyl)-N-(3-ethyl-2-morpholin-4-ylpentyl)propanamide is sourced from PubChem (CID 46539482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).