morpholine-4-carboximidamide;hydroiodide

C5H12IN3O — CID 2778396

IUPACmorpholine-4-carboximidamide;hydroiodide
SMILESI.[H]/N=C(\N)N1CCOCC1
InChIInChI=1S/C5H11N3O.HI/c6-5(7)8-1-3-9-4-2-8;/h1-4H2,(H3,6,7);1H
InChIKeyLJQSGLRGQQZIMF-UHFFFAOYSA-N
MW257.07 g/mol
LogP-0.17
Rot. Bonds

About morpholine-4-carboximidamide;hydroiodide

morpholine-4-carboximidamide;hydroiodide (PubChem CID 2778396) has the molecular formula C5H12IN3O and a molecular weight of 257.07 g/mol. Its IUPAC name is morpholine-4-carboximidamide;hydroiodide.

Molecular Properties

Compound Namemorpholine-4-carboximidamide;hydroiodide
PubChem CID2778396
Molecular FormulaC5H12IN3O
Molecular Weight257.07 g/mol
Exact Mass257.00
IUPAC Namemorpholine-4-carboximidamide;hydroiodide
SMILESI.[H]/N=C(\N)N1CCOCC1
InChIInChI=1S/C5H11N3O.HI/c6-5(7)8-1-3-9-4-2-8;/h1-4H2,(H3,6,7);1H
InChIKeyLJQSGLRGQQZIMF-UHFFFAOYSA-N
XLogP-0.17
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.07
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of morpholine-4-carboximidamide;hydroiodide?
The IUPAC name of morpholine-4-carboximidamide;hydroiodide (CID 2778396) is morpholine-4-carboximidamide;hydroiodide.
What is the SMILES notation for morpholine-4-carboximidamide;hydroiodide?
The canonical SMILES for morpholine-4-carboximidamide;hydroiodide is I.[H]/N=C(\N)N1CCOCC1.
What is the InChIKey of morpholine-4-carboximidamide;hydroiodide?
The InChIKey is LJQSGLRGQQZIMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O.HI/c6-5(7)8-1-3-9-4-2-8;/h1-4H2,(H3,6,7);1H.
What are the key properties of morpholine-4-carboximidamide;hydroiodide?
morpholine-4-carboximidamide;hydroiodide has a molecular weight of 257.07 g/mol, XLogP of -0.17, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for morpholine-4-carboximidamide;hydroiodide is sourced from PubChem (CID 2778396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).