2-morpholin-4-ylethanimidamide;hydrochloride

C6H14ClN3O — CID 14547439

IUPAC2-morpholin-4-ylethanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)CN1CCOCC1
InChIInChI=1S/C6H13N3O.ClH/c7-6(8)5-9-1-3-10-4-2-9;/h1-5H2,(H3,7,8);1H
InChIKeyWGWXHYOWXGZQLI-UHFFFAOYSA-N
MW179.65 g/mol
LogP-0.32
Rot. Bonds2

About 2-morpholin-4-ylethanimidamide;hydrochloride

2-morpholin-4-ylethanimidamide;hydrochloride (PubChem CID 14547439) has the molecular formula C6H14ClN3O and a molecular weight of 179.65 g/mol. Its IUPAC name is 2-morpholin-4-ylethanimidamide;hydrochloride.

Molecular Properties

Compound Name2-morpholin-4-ylethanimidamide;hydrochloride
PubChem CID14547439
Molecular FormulaC6H14ClN3O
Molecular Weight179.65 g/mol
Exact Mass179.08
IUPAC Name2-morpholin-4-ylethanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)CN1CCOCC1
InChIInChI=1S/C6H13N3O.ClH/c7-6(8)5-9-1-3-10-4-2-9;/h1-5H2,(H3,7,8);1H
InChIKeyWGWXHYOWXGZQLI-UHFFFAOYSA-N
XLogP-0.32
TPSA62.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.65
LogP ≤ 5-0.32
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'}

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylethanimidamide;hydrochloride?
The IUPAC name of 2-morpholin-4-ylethanimidamide;hydrochloride (CID 14547439) is 2-morpholin-4-ylethanimidamide;hydrochloride.
What is the SMILES notation for 2-morpholin-4-ylethanimidamide;hydrochloride?
The canonical SMILES for 2-morpholin-4-ylethanimidamide;hydrochloride is Cl.[H]/N=C(\N)CN1CCOCC1.
What is the InChIKey of 2-morpholin-4-ylethanimidamide;hydrochloride?
The InChIKey is WGWXHYOWXGZQLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O.ClH/c7-6(8)5-9-1-3-10-4-2-9;/h1-5H2,(H3,7,8);1H.
What are the key properties of 2-morpholin-4-ylethanimidamide;hydrochloride?
2-morpholin-4-ylethanimidamide;hydrochloride has a molecular weight of 179.65 g/mol, XLogP of -0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylethanimidamide;hydrochloride is sourced from PubChem (CID 14547439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).