4-methylmorpholine-2-carboximidamide

C6H13N3O — CID 75481075

IUPAC4-methylmorpholine-2-carboximidamide
SMILES[H]/N=C(\N)C1CN(C)CCO1
InChIInChI=1S/C6H13N3O/c1-9-2-3-10-5(4-9)6(7)8/h5H,2-4H2,1H3,(H3,7,8)
InChIKeyADYHKWHEJHSAGO-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.75
Rot. Bonds1

About 4-methylmorpholine-2-carboximidamide

4-methylmorpholine-2-carboximidamide (PubChem CID 75481075) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 4-methylmorpholine-2-carboximidamide.

Molecular Properties

Compound Name4-methylmorpholine-2-carboximidamide
PubChem CID75481075
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name4-methylmorpholine-2-carboximidamide
SMILES[H]/N=C(\N)C1CN(C)CCO1
InChIInChI=1S/C6H13N3O/c1-9-2-3-10-5(4-9)6(7)8/h5H,2-4H2,1H3,(H3,7,8)
InChIKeyADYHKWHEJHSAGO-UHFFFAOYSA-N
XLogP-0.75
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
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

methyl 4-methylmorpholine-2-carboximidate
CID 79089617
4-butylmorpholine-2-carboximidamide
CID 79680820
(2S)-N'-hydroxy-4-methylmorpholine-2-carboximidamide
CID 97045084
4-(1-methoxypropan-2-yl)morpholine-2-carboximidamide
CID 79675492
4-(piperidine-1-carbonyl)morpholine-2-carboximidamide
CID 79676441
4-[2-(1-methylpiperidin-2-yl)ethyl]morpholine-2-carboximidamide
CID 107912519
4-(4,6-dimethylpyrimidin-2-yl)morpholine-2-carboximidamide
CID 79676340
4-(4,6-dimethoxy-1,3,5-triazin-2-yl)morpholine-2-carboximidamide
CID 79676627
4-(2-methylphenyl)sulfonylmorpholine-2-carboximidamide
CID 79676830
(4-methylmorpholine-2-carbonyl)-λ2-stannane
CID 174736409
4-[(2,5-dimethylpyrazol-3-yl)methyl]morpholine-2-carboximidamide
CID 79675684
4-(4-propylphenyl)sulfonylmorpholine-2-carboximidamide
CID 79671137

Frequently Asked Questions

What is the IUPAC name of 4-methylmorpholine-2-carboximidamide?
The IUPAC name of 4-methylmorpholine-2-carboximidamide (CID 75481075) is 4-methylmorpholine-2-carboximidamide.
What is the SMILES notation for 4-methylmorpholine-2-carboximidamide?
The canonical SMILES for 4-methylmorpholine-2-carboximidamide is [H]/N=C(\N)C1CN(C)CCO1.
What is the InChIKey of 4-methylmorpholine-2-carboximidamide?
The InChIKey is ADYHKWHEJHSAGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-9-2-3-10-5(4-9)6(7)8/h5H,2-4H2,1H3,(H3,7,8).
What are the key properties of 4-methylmorpholine-2-carboximidamide?
4-methylmorpholine-2-carboximidamide has a molecular weight of 143.19 g/mol, XLogP of -0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylmorpholine-2-carboximidamide is sourced from PubChem (CID 75481075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).