2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide

C8H17N3O2 — CID 43592863

IUPAC2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
SMILESCC1(C)CN(C/C(N)=N/O)CCO1
InChIInChI=1S/C8H17N3O2/c1-8(2)6-11(3-4-13-8)5-7(9)10-12/h12H,3-6H2,1-2H3,(H2,9,10)
InChIKeyGYQHMOODIBYUAH-UHFFFAOYSA-N
MW187.24 g/mol
LogP-0.16
Rot. Bonds2

About 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide

2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide (PubChem CID 43592863) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
PubChem CID43592863
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
SMILESCC1(C)CN(C/C(N)=N/O)CCO1
InChIInChI=1S/C8H17N3O2/c1-8(2)6-11(3-4-13-8)5-7(9)10-12/h12H,3-6H2,1-2H3,(H2,9,10)
InChIKeyGYQHMOODIBYUAH-UHFFFAOYSA-N
XLogP-0.16
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
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

2-[(2,2-dimethylmorpholin-4-yl)methyl]-3,3,3-trifluoro-N'-hydroxypropanimidamide
CID 113807948
N'-hydroxy-4-morpholin-4-ylbutanimidamide
CID 22762054
2-(2,6-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
CID 24711778
N'-hydroxy-4-morpholin-4-ylbutanimidamide
CID 73997331
2-(2,6-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide
CID 74315250
N'-hydroxy-2-methyl-2-morpholin-4-ylpropanimidamide
CID 16775564
3-(2,6-dimethylmorpholin-4-yl)-N'-hydroxypropanimidamide
CID 24691298
N'-hydroxy-3-(2-methylmorpholin-4-yl)propanimidamide
CID 24702388
N'-hydroxy-2-(2-methylmorpholin-4-yl)ethanimidamide
CID 24703782
2-(2,6-Dimethylmorpholin-4-yl)ethanimidamide
CID 24705902
4-(2,6-dimethylmorpholin-4-yl)-N'-hydroxybutanimidamide
CID 24710363
N'-hydroxy-4-(2-methylmorpholin-4-yl)butanimidamide
CID 24711621

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
The IUPAC name of 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide (CID 43592863) is 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
The canonical SMILES for 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide is CC1(C)CN(C/C(N)=N/O)CCO1.
What is the InChIKey of 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
The InChIKey is GYQHMOODIBYUAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-8(2)6-11(3-4-13-8)5-7(9)10-12/h12H,3-6H2,1-2H3,(H2,9,10).
What are the key properties of 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide?
2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide has a molecular weight of 187.24 g/mol, XLogP of -0.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylmorpholin-4-yl)-N'-hydroxyethanimidamide is sourced from PubChem (CID 43592863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).