methanidyl(2-morpholin-4-ylethyl)azanium

C7H16N2O — CID 20723486

IUPACmethanidyl(2-morpholin-4-ylethyl)azanium
SMILES[CH2-][NH2+]CCN1CCOCC1
InChIInChI=1S/C7H16N2O/c1-8-2-3-9-4-6-10-7-5-9/h1-8H2
InChIKeyGHONAQLJRCZHAP-UHFFFAOYSA-N
MW144.22 g/mol
LogP-1.33
Rot. Bonds3

About methanidyl(2-morpholin-4-ylethyl)azanium

methanidyl(2-morpholin-4-ylethyl)azanium (PubChem CID 20723486) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is methanidyl(2-morpholin-4-ylethyl)azanium.

Molecular Properties

Compound Namemethanidyl(2-morpholin-4-ylethyl)azanium
PubChem CID20723486
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Namemethanidyl(2-morpholin-4-ylethyl)azanium
SMILES[CH2-][NH2+]CCN1CCOCC1
InChIInChI=1S/C7H16N2O/c1-8-2-3-9-4-6-10-7-5-9/h1-8H2
InChIKeyGHONAQLJRCZHAP-UHFFFAOYSA-N
XLogP-1.33
TPSA29.08 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-1.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methanidyl(2-morpholin-4-ylethyl)azanium?
The IUPAC name of methanidyl(2-morpholin-4-ylethyl)azanium (CID 20723486) is methanidyl(2-morpholin-4-ylethyl)azanium.
What is the SMILES notation for methanidyl(2-morpholin-4-ylethyl)azanium?
The canonical SMILES for methanidyl(2-morpholin-4-ylethyl)azanium is [CH2-][NH2+]CCN1CCOCC1.
What is the InChIKey of methanidyl(2-morpholin-4-ylethyl)azanium?
The InChIKey is GHONAQLJRCZHAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-8-2-3-9-4-6-10-7-5-9/h1-8H2.
What are the key properties of methanidyl(2-morpholin-4-ylethyl)azanium?
methanidyl(2-morpholin-4-ylethyl)azanium has a molecular weight of 144.22 g/mol, XLogP of -1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanidyl(2-morpholin-4-ylethyl)azanium is sourced from PubChem (CID 20723486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).