2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide

C10H20N4O3 — CID 111036986

IUPAC2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)C/N=C(\N)N1CCOCC1
InChIInChI=1S/C10H20N4O3/c1-16-5-2-12-9(15)8-13-10(11)14-3-6-17-7-4-14/h2-8H2,1H3,(H2,11,13)(H,12,15)
InChIKeyIKANVZUZJKHGFZ-UHFFFAOYSA-N
MW244.29 g/mol
LogP-1.60
Rot. Bonds5

About 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide

2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide (PubChem CID 111036986) has the molecular formula C10H20N4O3 and a molecular weight of 244.29 g/mol. Its IUPAC name is 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide
PubChem CID111036986
Molecular FormulaC10H20N4O3
Molecular Weight244.29 g/mol
Exact Mass244.15
IUPAC Name2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)C/N=C(\N)N1CCOCC1
InChIInChI=1S/C10H20N4O3/c1-16-5-2-12-9(15)8-13-10(11)14-3-6-17-7-4-14/h2-8H2,1H3,(H2,11,13)(H,12,15)
InChIKeyIKANVZUZJKHGFZ-UHFFFAOYSA-N
XLogP-1.60
TPSA89.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 5-1.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[[amino-[4-(4-chlorophenyl)piperazin-1-yl]methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111037054
2-[[amino-(3-morpholin-4-ylpropylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111037016
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide;hydroiodide
CID 120663315
N-(2-methoxyethyl)-2-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]acetamide
CID 112683464
tert-butyl 2-[[amino(morpholin-4-yl)methylidene]amino]acetate;hydroiodide
CID 119146780
N'-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-4-carboximidamide;hydroiodide
CID 111040241
N-(3-methoxypropyl)morpholine-4-carboxamide
CID 3136313
N-[2-[[amino(morpholin-4-yl)methylidene]amino]ethyl]-2-(4-fluorophenyl)acetamide
CID 111091936
N-[2-[[amino(morpholin-4-yl)methylidene]amino]ethyl]-2-(4-fluorophenyl)acetamide;hydroiodide
CID 111091935
2-[[amino(propylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111036987
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(4-iodophenyl)acetamide;hydroiodide
CID 120913573
1-(2-methoxyethyl)-2-(2-methyl-2-morpholin-4-ylpropyl)guanidine
CID 51131421

Frequently Asked Questions

What is the IUPAC name of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide (CID 111036986) is 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)C/N=C(\N)N1CCOCC1.
What is the InChIKey of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is IKANVZUZJKHGFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N4O3/c1-16-5-2-12-9(15)8-13-10(11)14-3-6-17-7-4-14/h2-8H2,1H3,(H2,11,13)(H,12,15).
What are the key properties of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide?
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 244.29 g/mol, XLogP of -1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 111036986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).