2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide

C7H15N3O2 — CID 102936516

IUPAC2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide
SMILES[H]/N=C(\N)N1CC(C)OC(CO)C1
InChIInChI=1S/C7H15N3O2/c1-5-2-10(7(8)9)3-6(4-11)12-5/h5-6,11H,2-4H2,1H3,(H3,8,9)
InChIKeyBZEHUPXAPXXMCM-UHFFFAOYSA-N
MW173.22 g/mol
LogP-1.04
Rot. Bonds1

About 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide

2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide (PubChem CID 102936516) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide.

Molecular Properties

Compound Name2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide
PubChem CID102936516
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide
SMILES[H]/N=C(\N)N1CC(C)OC(CO)C1
InChIInChI=1S/C7H15N3O2/c1-5-2-10(7(8)9)3-6(4-11)12-5/h5-6,11H,2-4H2,1H3,(H3,8,9)
InChIKeyBZEHUPXAPXXMCM-UHFFFAOYSA-N
XLogP-1.04
TPSA82.57 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-1.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(4-butanimidoyl-6-methylmorpholin-2-yl)methanol
CID 102936546
2-hydroxyethyl 2-(hydroxymethyl)-6-methylmorpholine-4-carboxylate
CID 102938985
3-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]butanimidamide
CID 102933118
4-hydroxy-3,5-dimethylpiperidine-1-carboximidamide
CID 170614400
(3R,5S)-3,5-dimethylpiperazine-1-carboximidamide
CID 45088464
2-amino-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-4-methylpentan-1-one
CID 102932545
(1-aminocyclopropyl)-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]methanone
CID 102932645
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-methylsulfanylethanone
CID 102934667
2,2-difluoro-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]ethanone
CID 103514025
2-amino-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]pent-4-en-1-one
CID 102932657
(2R)-2-amino-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-3,3-dimethylbutan-1-one
CID 102932602
3-amino-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]pentan-1-one
CID 102932658

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide?
The IUPAC name of 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide (CID 102936516) is 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide.
What is the SMILES notation for 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide?
The canonical SMILES for 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide is [H]/N=C(\N)N1CC(C)OC(CO)C1.
What is the InChIKey of 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide?
The InChIKey is BZEHUPXAPXXMCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2/c1-5-2-10(7(8)9)3-6(4-11)12-5/h5-6,11H,2-4H2,1H3,(H3,8,9).
What are the key properties of 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide?
2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide has a molecular weight of 173.22 g/mol, XLogP of -1.04, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-6-methylmorpholine-4-carboximidamide is sourced from PubChem (CID 102936516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).