N-ethenyl-2-morpholin-4-ylethanamine

C8H16N2O — CID 137450496

IUPACN-ethenyl-2-morpholin-4-ylethanamine
SMILESC=CNCCN1CCOCC1
InChIInChI=1S/C8H16N2O/c1-2-9-3-4-10-5-7-11-8-6-10/h2,9H,1,3-8H2
InChIKeyJPFXOVNGTJQBSE-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.05
Rot. Bonds4

About N-ethenyl-2-morpholin-4-ylethanamine

N-ethenyl-2-morpholin-4-ylethanamine (PubChem CID 137450496) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-ethenyl-2-morpholin-4-ylethanamine.

Molecular Properties

Compound NameN-ethenyl-2-morpholin-4-ylethanamine
PubChem CID137450496
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-ethenyl-2-morpholin-4-ylethanamine
SMILESC=CNCCN1CCOCC1
InChIInChI=1S/C8H16N2O/c1-2-9-3-4-10-5-7-11-8-6-10/h2,9H,1,3-8H2
InChIKeyJPFXOVNGTJQBSE-UHFFFAOYSA-N
XLogP0.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethenyl-2-morpholin-4-ylethanamine?
The IUPAC name of N-ethenyl-2-morpholin-4-ylethanamine (CID 137450496) is N-ethenyl-2-morpholin-4-ylethanamine.
What is the SMILES notation for N-ethenyl-2-morpholin-4-ylethanamine?
The canonical SMILES for N-ethenyl-2-morpholin-4-ylethanamine is C=CNCCN1CCOCC1.
What is the InChIKey of N-ethenyl-2-morpholin-4-ylethanamine?
The InChIKey is JPFXOVNGTJQBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-2-9-3-4-10-5-7-11-8-6-10/h2,9H,1,3-8H2.
What are the key properties of N-ethenyl-2-morpholin-4-ylethanamine?
N-ethenyl-2-morpholin-4-ylethanamine has a molecular weight of 156.23 g/mol, XLogP of 0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-2-morpholin-4-ylethanamine is sourced from PubChem (CID 137450496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).