3-methylmorpholine-2-carboximidamide

C6H13N3O — CID 18435490

IUPAC3-methylmorpholine-2-carboximidamide
SMILES[H]/N=C(\N)C1OCCNC1C
InChIInChI=1S/C6H13N3O/c1-4-5(6(7)8)10-3-2-9-4/h4-5,9H,2-3H2,1H3,(H3,7,8)
InChIKeyAIMZMNQUNZNLPE-UHFFFAOYSA-N
MW143.19 g/mol
LogP-0.70
Rot. Bonds1

About 3-methylmorpholine-2-carboximidamide

3-methylmorpholine-2-carboximidamide (PubChem CID 18435490) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 3-methylmorpholine-2-carboximidamide.

Molecular Properties

Compound Name3-methylmorpholine-2-carboximidamide
PubChem CID18435490
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name3-methylmorpholine-2-carboximidamide
SMILES[H]/N=C(\N)C1OCCNC1C
InChIInChI=1S/C6H13N3O/c1-4-5(6(7)8)10-3-2-9-4/h4-5,9H,2-3H2,1H3,(H3,7,8)
InChIKeyAIMZMNQUNZNLPE-UHFFFAOYSA-N
XLogP-0.70
TPSA71.13 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.70
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'}

Analyze 3-methylmorpholine-2-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methylmorpholine-2-carboximidamide?
The IUPAC name of 3-methylmorpholine-2-carboximidamide (CID 18435490) is 3-methylmorpholine-2-carboximidamide.
What is the SMILES notation for 3-methylmorpholine-2-carboximidamide?
The canonical SMILES for 3-methylmorpholine-2-carboximidamide is [H]/N=C(\N)C1OCCNC1C.
What is the InChIKey of 3-methylmorpholine-2-carboximidamide?
The InChIKey is AIMZMNQUNZNLPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-4-5(6(7)8)10-3-2-9-4/h4-5,9H,2-3H2,1H3,(H3,7,8).
What are the key properties of 3-methylmorpholine-2-carboximidamide?
3-methylmorpholine-2-carboximidamide has a molecular weight of 143.19 g/mol, XLogP of -0.70, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylmorpholine-2-carboximidamide is sourced from PubChem (CID 18435490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).