2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide

C12H25N3O3 — CID 108994050

IUPAC2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCOCCCNCC(=O)NCCN1CCOCC1
InChIInChI=1S/C12H25N3O3/c1-17-8-2-3-13-11-12(16)14-4-5-15-6-9-18-10-7-15/h13H,2-11H2,1H3,(H,14,16)
InChIKeyMQRJXQKHYAGPDA-UHFFFAOYSA-N
MW259.35 g/mol
LogP-0.94
Rot. Bonds9

About 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide

2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 108994050) has the molecular formula C12H25N3O3 and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID108994050
Molecular FormulaC12H25N3O3
Molecular Weight259.35 g/mol
Exact Mass259.19
IUPAC Name2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCOCCCNCC(=O)NCCN1CCOCC1
InChIInChI=1S/C12H25N3O3/c1-17-8-2-3-13-11-12(16)14-4-5-15-6-9-18-10-7-15/h13H,2-11H2,1H3,(H,14,16)
InChIKeyMQRJXQKHYAGPDA-UHFFFAOYSA-N
XLogP-0.94
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 5-0.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)propanamide
CID 109015495
2-(2-methoxyethylamino)-N-(4-morpholin-4-ylbutyl)acetamide;dihydrochloride
CID 119852507
2-(2-methoxyethoxy)-N-(3-morpholin-4-ylpropyl)acetamide
CID 103606858
1-(2-methoxyethoxymethyl)-3-(2-morpholin-4-ylethyl)urea
CID 108894367
1-(3-methoxypropyl)-3-(3-morpholin-4-ylpropyl)thiourea
CID 115570403
2-(4-methoxybutylamino)-1-morpholin-4-ylethanone
CID 60975832
N,N'-bis(3-morpholin-4-ylpropyl)propanediamide
CID 21205309
2-(2-methoxyethylamino)-N-(3-methoxypropyl)acetamide;hydrochloride
CID 119672351
(Z)-2-cyano-3-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)prop-2-enamide
CID 108862940
3,5-dimethoxy-N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]benzamide
CID 110285157
1-[3-(2-methoxyethoxy)propyl]-2-methyl-3-(2-morpholin-4-ylethyl)guanidine;hydroiodide
CID 111035845
2-(2-hydroxyethylamino)-N-(3-methoxypropyl)acetamide
CID 60647414

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide (CID 108994050) is 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide is COCCCNCC(=O)NCCN1CCOCC1.
What is the InChIKey of 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is MQRJXQKHYAGPDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O3/c1-17-8-2-3-13-11-12(16)14-4-5-15-6-9-18-10-7-15/h13H,2-11H2,1H3,(H,14,16).
What are the key properties of 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide?
2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 259.35 g/mol, XLogP of -0.94, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropylamino)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 108994050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).