2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide

C15H22N4O2 — CID 111093861

IUPAC2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)C/N=C(\N)N2CCOCC2)c1
InChIInChI=1S/C15H22N4O2/c1-2-12-4-3-5-13(10-12)18-14(20)11-17-15(16)19-6-8-21-9-7-19/h3-5,10H,2,6-9,11H2,1H3,(H2,16,17)(H,18,20)
InChIKeyAEXZIAKSGALLNB-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.83
Rot. Bonds4

About 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide

2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide (PubChem CID 111093861) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide
PubChem CID111093861
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide
SMILESCCc1cccc(NC(=O)C/N=C(\N)N2CCOCC2)c1
InChIInChI=1S/C15H22N4O2/c1-2-12-4-3-5-13(10-12)18-14(20)11-17-15(16)19-6-8-21-9-7-19/h3-5,10H,2,6-9,11H2,1H3,(H2,16,17)(H,18,20)
InChIKeyAEXZIAKSGALLNB-UHFFFAOYSA-N
XLogP0.83
TPSA79.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[[amino(thiomorpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide;hydroiodide
CID 111093912
2-[[amino-(4-methylpiperidin-1-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide;hydroiodide
CID 110930365
N-[3-[[[amino(morpholin-4-yl)methylidene]amino]methyl]phenyl]acetamide;hydroiodide
CID 111044863
2-[[amino-[4-(1,3-thiazol-2-yl)piperazin-1-yl]methylidene]amino]-N-(3-ethylphenyl)acetamide;hydroiodide
CID 111093926
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(4-iodophenyl)acetamide;hydroiodide
CID 120913573
1-(3-ethylphenyl)-2-[(4-morpholin-4-ylphenyl)methyl]guanidine
CID 111063114
2-[[ethylamino-(3-morpholin-4-ylpropylamino)methylidene]amino]-N-(3-ethylphenyl)acetamide
CID 110972239
N-[3-[[[amino(morpholin-4-yl)methylidene]amino]methyl]phenyl]cyclopentanecarboxamide
CID 111075141
2-[[ethylamino-[(3-methyl-2-morpholin-4-ylbutyl)amino]methylidene]amino]-N-(3-ethylphenyl)acetamide;hydroiodide
CID 111930905
2-[[amino-(butan-2-ylamino)methylidene]amino]-N-(3-ethylphenyl)acetamide;hydroiodide
CID 110930363
2-[[amino-(3-ethylanilino)methylidene]amino]-N-(3-fluorophenyl)acetamide;hydroiodide
CID 111089416
1-(3-ethylphenyl)-2-(2-oxo-2-piperidin-1-ylethyl)guanidine;hydroiodide
CID 111058321

Frequently Asked Questions

What is the IUPAC name of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide?
The IUPAC name of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide (CID 111093861) is 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide.
What is the SMILES notation for 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide?
The canonical SMILES for 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide is CCc1cccc(NC(=O)C/N=C(\N)N2CCOCC2)c1.
What is the InChIKey of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide?
The InChIKey is AEXZIAKSGALLNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-2-12-4-3-5-13(10-12)18-14(20)11-17-15(16)19-6-8-21-9-7-19/h3-5,10H,2,6-9,11H2,1H3,(H2,16,17)(H,18,20).
What are the key properties of 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide?
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide has a molecular weight of 290.37 g/mol, XLogP of 0.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino(morpholin-4-yl)methylidene]amino]-N-(3-ethylphenyl)acetamide is sourced from PubChem (CID 111093861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).