3-ethylmorpholine-4-carboximidamide

C7H15N3O — CID 43613320

IUPAC3-ethylmorpholine-4-carboximidamide
SMILES[H]/N=C(\N)N1CCOCC1CC
InChIInChI=1S/C7H15N3O/c1-2-6-5-11-4-3-10(6)7(8)9/h6H,2-5H2,1H3,(H3,8,9)
InChIKeyBAOMBRDQPFATQJ-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.01
Rot. Bonds1

About 3-ethylmorpholine-4-carboximidamide

3-ethylmorpholine-4-carboximidamide (PubChem CID 43613320) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 3-ethylmorpholine-4-carboximidamide.

Molecular Properties

Compound Name3-ethylmorpholine-4-carboximidamide
PubChem CID43613320
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name3-ethylmorpholine-4-carboximidamide
SMILES[H]/N=C(\N)N1CCOCC1CC
InChIInChI=1S/C7H15N3O/c1-2-6-5-11-4-3-10(6)7(8)9/h6H,2-5H2,1H3,(H3,8,9)
InChIKeyBAOMBRDQPFATQJ-UHFFFAOYSA-N
XLogP-0.01
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.01
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'}

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Related Compounds

Morpholine-4-carboximidamide Hydroiodide
CID 2778396
Morpholinoamidine
CID 205053
Morpholine-4-carboximidamide Hydrobromide
CID 2806564
2,6-Dimethylmorpholine-4-carboximidamide bromide
CID 45108822
Morpholine-4-carboximidamide hydrochloride
CID 12427952
2,6-dimethylmorpholine-4-carboximidamide Hydrobromide
CID 2806562
2,6-Dimethylmorpholine-4-carboximidamide
CID 2806563
2-Methylmorpholine-4-carboximidamide
CID 12011845
3-Methylmorpholine-4-carboximidamide
CID 12011846
3,5-Dimethylmorpholine-4-carboximidamide
CID 15186359
3,3-Dimethylmorpholine-4-carboximidamide
CID 53843002
N,N-dimethylmorpholine-4-carboximidamide
CID 54038202

Frequently Asked Questions

What is the IUPAC name of 3-ethylmorpholine-4-carboximidamide?
The IUPAC name of 3-ethylmorpholine-4-carboximidamide (CID 43613320) is 3-ethylmorpholine-4-carboximidamide.
What is the SMILES notation for 3-ethylmorpholine-4-carboximidamide?
The canonical SMILES for 3-ethylmorpholine-4-carboximidamide is [H]/N=C(\N)N1CCOCC1CC.
What is the InChIKey of 3-ethylmorpholine-4-carboximidamide?
The InChIKey is BAOMBRDQPFATQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-2-6-5-11-4-3-10(6)7(8)9/h6H,2-5H2,1H3,(H3,8,9).
What are the key properties of 3-ethylmorpholine-4-carboximidamide?
3-ethylmorpholine-4-carboximidamide has a molecular weight of 157.22 g/mol, XLogP of -0.01, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylmorpholine-4-carboximidamide is sourced from PubChem (CID 43613320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).