N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide

C10H20IN3O2 — CID 119118475

IUPACN'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide
SMILESI.N/C(=N\CC1CCOC1)N1CCOCC1
InChIInChI=1S/C10H19N3O2.HI/c11-10(13-2-5-14-6-3-13)12-7-9-1-4-15-8-9;/h9H,1-8H2,(H2,11,12);1H
InChIKeyVTAJOTKUGYBQHD-UHFFFAOYSA-N
MW341.19 g/mol
LogP0.29
Rot. Bonds2

About N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide

N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide (PubChem CID 119118475) has the molecular formula C10H20IN3O2 and a molecular weight of 341.19 g/mol. Its IUPAC name is N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide.

Molecular Properties

Compound NameN'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide
PubChem CID119118475
Molecular FormulaC10H20IN3O2
Molecular Weight341.19 g/mol
Exact Mass341.06
IUPAC NameN'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide
SMILESI.N/C(=N\CC1CCOC1)N1CCOCC1
InChIInChI=1S/C10H19N3O2.HI/c11-10(13-2-5-14-6-3-13)12-7-9-1-4-15-8-9;/h9H,1-8H2,(H2,11,12);1H
InChIKeyVTAJOTKUGYBQHD-UHFFFAOYSA-N
XLogP0.29
TPSA60.08 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.19
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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Related Compounds

N'-(thian-4-ylmethyl)morpholine-4-carboximidamide;hydroiodide
CID 119146805
4-(4-fluorophenyl)-N'-(oxan-3-ylmethyl)piperazine-1-carboximidamide
CID 119119749
N'-[[1-(cyclohexylmethyl)pyrrolidin-2-yl]methyl]morpholine-4-carboximidamide;hydroiodide
CID 111807627
N'-(3-cyclopropylpropyl)morpholine-4-carboximidamide
CID 111816668
N'-[(2-cyclopropylcyclopentyl)methyl]morpholine-4-carboximidamide
CID 122098985
N'-[3-[[(3S)-oxolan-3-yl]methoxy]propyl]azepane-1-carboximidamide
CID 99849009
N'-[(1-morpholin-4-ylcyclopropyl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 120558150
N'-[2-(2-bicyclo[2.2.1]heptanyl)ethyl]morpholine-4-carboximidamide;hydroiodide
CID 111072508
N'-[(4-hydroxyoxan-4-yl)methyl]morpholine-4-carboximidamide
CID 119120839
N'-(2-ethoxyethyl)morpholine-4-carboximidamide;hydroiodide
CID 111045505
N'-[(2-phenyloxan-3-yl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 111075066
N'-[(3-methoxyoxan-4-yl)methyl]azepane-1-carboximidamide
CID 122097381

Frequently Asked Questions

What is the IUPAC name of N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide?
The IUPAC name of N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide (CID 119118475) is N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide.
What is the SMILES notation for N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide?
The canonical SMILES for N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide is I.N/C(=N\CC1CCOC1)N1CCOCC1.
What is the InChIKey of N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide?
The InChIKey is VTAJOTKUGYBQHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2.HI/c11-10(13-2-5-14-6-3-13)12-7-9-1-4-15-8-9;/h9H,1-8H2,(H2,11,12);1H.
What are the key properties of N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide?
N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide has a molecular weight of 341.19 g/mol, XLogP of 0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(oxolan-3-ylmethyl)morpholine-4-carboximidamide;hydroiodide is sourced from PubChem (CID 119118475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).