4-methyl-3-[(E)-prop-1-enyl]morpholine

C8H15NO — CID 90058856

IUPAC4-methyl-3-[(E)-prop-1-enyl]morpholine
SMILESC/C=C/C1COCCN1C
InChIInChI=1S/C8H15NO/c1-3-4-8-7-10-6-5-9(8)2/h3-4,8H,5-7H2,1-2H3/b4-3+
InChIKeyIGZZBXMZKIORMB-ONEGZZNKSA-N
MW141.21 g/mol
LogP0.89
Rot. Bonds1

About 4-methyl-3-[(E)-prop-1-enyl]morpholine

4-methyl-3-[(E)-prop-1-enyl]morpholine (PubChem CID 90058856) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 4-methyl-3-[(E)-prop-1-enyl]morpholine.

Molecular Properties

Compound Name4-methyl-3-[(E)-prop-1-enyl]morpholine
PubChem CID90058856
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name4-methyl-3-[(E)-prop-1-enyl]morpholine
SMILESC/C=C/C1COCCN1C
InChIInChI=1S/C8H15NO/c1-3-4-8-7-10-6-5-9(8)2/h3-4,8H,5-7H2,1-2H3/b4-3+
InChIKeyIGZZBXMZKIORMB-ONEGZZNKSA-N
XLogP0.89
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(E)-prop-1-enyl]morpholine?
The IUPAC name of 4-methyl-3-[(E)-prop-1-enyl]morpholine (CID 90058856) is 4-methyl-3-[(E)-prop-1-enyl]morpholine.
What is the SMILES notation for 4-methyl-3-[(E)-prop-1-enyl]morpholine?
The canonical SMILES for 4-methyl-3-[(E)-prop-1-enyl]morpholine is C/C=C/C1COCCN1C.
What is the InChIKey of 4-methyl-3-[(E)-prop-1-enyl]morpholine?
The InChIKey is IGZZBXMZKIORMB-ONEGZZNKSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-4-8-7-10-6-5-9(8)2/h3-4,8H,5-7H2,1-2H3/b4-3+.
What are the key properties of 4-methyl-3-[(E)-prop-1-enyl]morpholine?
4-methyl-3-[(E)-prop-1-enyl]morpholine has a molecular weight of 141.21 g/mol, XLogP of 0.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(E)-prop-1-enyl]morpholine is sourced from PubChem (CID 90058856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).