N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide

C10H22N4O2 — CID 43186620

IUPACN'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide
SMILESCN(CC/C(N)=N/O)CCN1CCOCC1
InChIInChI=1S/C10H22N4O2/c1-13(3-2-10(11)12-15)4-5-14-6-8-16-9-7-14/h15H,2-9H2,1H3,(H2,11,12)
InChIKeyNHIRMUQUKYFILK-UHFFFAOYSA-N
MW230.31 g/mol
LogP-0.61
Rot. Bonds6

About N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide

N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide (PubChem CID 43186620) has the molecular formula C10H22N4O2 and a molecular weight of 230.31 g/mol. Its IUPAC name is N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide.

Molecular Properties

Compound NameN'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide
PubChem CID43186620
Molecular FormulaC10H22N4O2
Molecular Weight230.31 g/mol
Exact Mass230.17
IUPAC NameN'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide
SMILESCN(CC/C(N)=N/O)CCN1CCOCC1
InChIInChI=1S/C10H22N4O2/c1-13(3-2-10(11)12-15)4-5-14-6-8-16-9-7-14/h15H,2-9H2,1H3,(H2,11,12)
InChIKeyNHIRMUQUKYFILK-UHFFFAOYSA-N
XLogP-0.61
TPSA74.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 5-0.61
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'}

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Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide?
The IUPAC name of N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide (CID 43186620) is N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide.
What is the SMILES notation for N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide?
The canonical SMILES for N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide is CN(CC/C(N)=N/O)CCN1CCOCC1.
What is the InChIKey of N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide?
The InChIKey is NHIRMUQUKYFILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2/c1-13(3-2-10(11)12-15)4-5-14-6-8-16-9-7-14/h15H,2-9H2,1H3,(H2,11,12).
What are the key properties of N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide?
N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide has a molecular weight of 230.31 g/mol, XLogP of -0.61, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-3-[methyl(2-morpholin-4-ylethyl)amino]propanimidamide is sourced from PubChem (CID 43186620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).