3-ethyl-N'-hydroxymorpholine-4-carboximidamide

C7H15N3O2 — CID 62481677

IUPAC3-ethyl-N'-hydroxymorpholine-4-carboximidamide
SMILESCCC1COCCN1/C(N)=N/O
InChIInChI=1S/C7H15N3O2/c1-2-6-5-12-4-3-10(6)7(8)9-11/h6,11H,2-5H2,1H3,(H2,8,9)
InChIKeyYIZJPWPSGYSUDE-UHFFFAOYSA-N
MW173.22 g/mol
LogP-0.20
Rot. Bonds1

About 3-ethyl-N'-hydroxymorpholine-4-carboximidamide

3-ethyl-N'-hydroxymorpholine-4-carboximidamide (PubChem CID 62481677) has the molecular formula C7H15N3O2 and a molecular weight of 173.22 g/mol. Its IUPAC name is 3-ethyl-N'-hydroxymorpholine-4-carboximidamide.

Molecular Properties

Compound Name3-ethyl-N'-hydroxymorpholine-4-carboximidamide
PubChem CID62481677
Molecular FormulaC7H15N3O2
Molecular Weight173.22 g/mol
Exact Mass173.12
IUPAC Name3-ethyl-N'-hydroxymorpholine-4-carboximidamide
SMILESCCC1COCCN1/C(N)=N/O
InChIInChI=1S/C7H15N3O2/c1-2-6-5-12-4-3-10(6)7(8)9-11/h6,11H,2-5H2,1H3,(H2,8,9)
InChIKeyYIZJPWPSGYSUDE-UHFFFAOYSA-N
XLogP-0.20
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.22
LogP ≤ 5-0.20
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'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-ethyl-2-(3-ethylmorpholine-4-carbonyl)-N'-hydroxybutanimidamide
CID 76920708
3-(3-ethylmorpholin-4-yl)-3-oxopropanethioamide
CID 43613382
3-ethylmorpholine-4-carbonyl chloride
CID 79887430
2-amino-1-(3-ethylmorpholin-4-yl)propan-1-one
CID 43613241
2-(3-ethylmorpholin-4-yl)-2-oxoacetohydrazide
CID 43613615
3-(3-ethylmorpholine-4-carbonyl)-N'-hydroxybenzenecarboximidamide
CID 43613610
1-(3-ethylmorpholin-4-yl)ethanimine
CID 63172920
2-hydroxyethyl 3-ethylmorpholine-4-carboxylate
CID 79349487
N-(2-aminoethyl)-3-ethyl-N-methylmorpholine-4-carboxamide
CID 82509083
N'-hydroxy-3-[3-(hydroxymethyl)morpholin-4-yl]-2-methyl-3-oxopropanimidamide
CID 104877501
2-(2-aminocyclohexyl)-1-(3-ethylmorpholin-4-yl)ethanone
CID 62782698
(4-aminocyclohexyl)-(3-ethylmorpholin-4-yl)methanone
CID 60847443

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N'-hydroxymorpholine-4-carboximidamide?
The IUPAC name of 3-ethyl-N'-hydroxymorpholine-4-carboximidamide (CID 62481677) is 3-ethyl-N'-hydroxymorpholine-4-carboximidamide.
What is the SMILES notation for 3-ethyl-N'-hydroxymorpholine-4-carboximidamide?
The canonical SMILES for 3-ethyl-N'-hydroxymorpholine-4-carboximidamide is CCC1COCCN1/C(N)=N/O.
What is the InChIKey of 3-ethyl-N'-hydroxymorpholine-4-carboximidamide?
The InChIKey is YIZJPWPSGYSUDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O2/c1-2-6-5-12-4-3-10(6)7(8)9-11/h6,11H,2-5H2,1H3,(H2,8,9).
What are the key properties of 3-ethyl-N'-hydroxymorpholine-4-carboximidamide?
3-ethyl-N'-hydroxymorpholine-4-carboximidamide has a molecular weight of 173.22 g/mol, XLogP of -0.20, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N'-hydroxymorpholine-4-carboximidamide is sourced from PubChem (CID 62481677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).