2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide

C8H17N3O2 — CID 43613259

IUPAC2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide
SMILESCCC1COCCN1C/C(N)=N/O
InChIInChI=1S/C8H17N3O2/c1-2-7-6-13-4-3-11(7)5-8(9)10-12/h7,12H,2-6H2,1H3,(H2,9,10)
InChIKeyCUIRJKPEWRXNSE-UHFFFAOYSA-N
MW187.24 g/mol
LogP-0.16
Rot. Bonds3

About 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide

2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide (PubChem CID 43613259) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide
PubChem CID43613259
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide
SMILESCCC1COCCN1C/C(N)=N/O
InChIInChI=1S/C8H17N3O2/c1-2-7-6-13-4-3-11(7)5-8(9)10-12/h7,12H,2-6H2,1H3,(H2,9,10)
InChIKeyCUIRJKPEWRXNSE-UHFFFAOYSA-N
XLogP-0.16
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

N'-hydroxy-2-[4-[2-(2,2,2-trifluoroethoxy)ethyl]piperazin-1-yl]butanimidamide
CID 77012153
N'-hydroxy-2-[4-[2-(2,2,2-trifluoroethoxy)ethyl]piperazin-1-yl]propanimidamide
CID 77012503
N'-hydroxy-2-[4-[2-(trifluoromethoxy)ethyl]piperazin-1-yl]butanimidamide
CID 77100309
N'-hydroxy-4-morpholin-4-ylbutanimidamide
CID 22762054
2-(2,6-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
CID 24711778
(1Z)-N'-Hydroxy-2-(4-morpholinyl)propanimidamide
CID 45791226
N'-hydroxy-2-morpholino-propanamidine
CID 53433452
N'-hydroxy-4-morpholin-4-ylbutanimidamide
CID 73997331
2-(2,6-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
CID 74315250
CID 74788795
CID 74788795
4-(3-Methylmorpholin-4-yl)-4,5-dihydro-1,2-oxazol-3-amine
CID 141069560
N'-hydroxy-2-methyl-2-morpholin-4-ylpropanimidamide
CID 16775564

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
The IUPAC name of 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide (CID 43613259) is 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
The canonical SMILES for 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide is CCC1COCCN1C/C(N)=N/O.
What is the InChIKey of 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
The InChIKey is CUIRJKPEWRXNSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-2-7-6-13-4-3-11(7)5-8(9)10-12/h7,12H,2-6H2,1H3,(H2,9,10).
What are the key properties of 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide has a molecular weight of 187.24 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylmorpholin-4-yl)-N'-hydroxyethanimidamide is sourced from PubChem (CID 43613259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).