N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide

C9H20N4O2 — CID 76929225

IUPACN'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide
SMILESCN(CCN1CCOCC1)CC(N)=NO
InChIInChI=1S/C9H20N4O2/c1-12(8-9(10)11-14)2-3-13-4-6-15-7-5-13/h14H,2-8H2,1H3,(H2,10,11)
InChIKeyDQTHZONWSIDHAU-UHFFFAOYSA-N
MW216.28 g/mol
LogP-1.00
Rot. Bonds5

About N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide

N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide (PubChem CID 76929225) has the molecular formula C9H20N4O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide.

Molecular Properties

Compound NameN'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide
PubChem CID76929225
Molecular FormulaC9H20N4O2
Molecular Weight216.28 g/mol
Exact Mass216.16
IUPAC NameN'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide
SMILESCN(CCN1CCOCC1)CC(N)=NO
InChIInChI=1S/C9H20N4O2/c1-12(8-9(10)11-14)2-3-13-4-6-15-7-5-13/h14H,2-8H2,1H3,(H2,10,11)
InChIKeyDQTHZONWSIDHAU-UHFFFAOYSA-N
XLogP-1.00
TPSA74.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide?
The IUPAC name of N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide (CID 76929225) is N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide.
What is the SMILES notation for N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide?
The canonical SMILES for N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide is CN(CCN1CCOCC1)CC(N)=NO.
What is the InChIKey of N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide?
The InChIKey is DQTHZONWSIDHAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N4O2/c1-12(8-9(10)11-14)2-3-13-4-6-15-7-5-13/h14H,2-8H2,1H3,(H2,10,11).
What are the key properties of N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide?
N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide has a molecular weight of 216.28 g/mol, XLogP of -1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-[methyl(2-morpholin-4-ylethyl)amino]ethanimidamide is sourced from PubChem (CID 76929225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).