N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide

C8H19N3O3 — CID 104861637

IUPACN'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide
SMILESCOCCN(CCO)C(C)C(N)=NO
InChIInChI=1S/C8H19N3O3/c1-7(8(9)10-13)11(3-5-12)4-6-14-2/h7,12-13H,3-6H2,1-2H3,(H2,9,10)
InChIKeyCDBOPAZARKOPAP-UHFFFAOYSA-N
MW205.26 g/mol
LogP-0.94
Rot. Bonds7

About N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide

N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide (PubChem CID 104861637) has the molecular formula C8H19N3O3 and a molecular weight of 205.26 g/mol. Its IUPAC name is N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide.

Molecular Properties

Compound NameN'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide
PubChem CID104861637
Molecular FormulaC8H19N3O3
Molecular Weight205.26 g/mol
Exact Mass205.14
IUPAC NameN'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide
SMILESCOCCN(CCO)C(C)C(N)=NO
InChIInChI=1S/C8H19N3O3/c1-7(8(9)10-13)11(3-5-12)4-6-14-2/h7,12-13H,3-6H2,1-2H3,(H2,9,10)
InChIKeyCDBOPAZARKOPAP-UHFFFAOYSA-N
XLogP-0.94
TPSA91.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
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-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide 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

2-[bis(2-methoxyethyl)amino]-N'-hydroxypropanimidamide
CID 76914953
2-[ethyl(2-hydroxyethyl)amino]-N'-hydroxypropanimidamide
CID 76915046
N'-hydroxy-2-[2-[2-methoxyethyl(propan-2-yl)amino]ethoxy]propanimidamide
CID 114266354
N'-hydroxy-2-[3-(2-methoxyethoxy)propyl-methylamino]propanimidamide
CID 103409990
2-[bis(2-methylpropyl)amino]-N'-hydroxypropanimidamide
CID 76915169
3-amino-2-[bis(2-methoxyethyl)amino]butan-1-ol
CID 64899164
3-[cyclopropyl(2-methoxyethyl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 61451610
3-[ethyl(4-methoxybutan-2-yl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 104881692
2-[2-(3-methoxypropoxy)ethyl-propan-2-ylamino]ethanol
CID 103182683
N'-hydroxy-2-[methyl(2-propan-2-yloxyethyl)amino]propanimidamide
CID 76928096
2-[4-methoxybutyl(propan-2-yl)amino]ethanol
CID 115685977
N-butan-2-yl-2-(N'-hydroxycarbamimidoyl)-N-(2-methoxyethyl)-3-methylbutanamide
CID 76924055

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide?
The IUPAC name of N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide (CID 104861637) is N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide.
What is the SMILES notation for N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide?
The canonical SMILES for N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide is COCCN(CCO)C(C)C(N)=NO.
What is the InChIKey of N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide?
The InChIKey is CDBOPAZARKOPAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O3/c1-7(8(9)10-13)11(3-5-12)4-6-14-2/h7,12-13H,3-6H2,1-2H3,(H2,9,10).
What are the key properties of N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide?
N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide has a molecular weight of 205.26 g/mol, XLogP of -0.94, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-2-[2-hydroxyethyl(2-methoxyethyl)amino]propanimidamide is sourced from PubChem (CID 104861637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).