2-(2-methylprop-1-enyl)morpholine

C8H15NO — CID 67801913

IUPAC2-(2-methylprop-1-enyl)morpholine
SMILESCC(C)=CC1CNCCO1
InChIInChI=1S/C8H15NO/c1-7(2)5-8-6-9-3-4-10-8/h5,8-9H,3-4,6H2,1-2H3
InChIKeyJRVIPZAVTNIGQQ-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.94
Rot. Bonds1

About 2-(2-methylprop-1-enyl)morpholine

2-(2-methylprop-1-enyl)morpholine (PubChem CID 67801913) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-(2-methylprop-1-enyl)morpholine.

Molecular Properties

Compound Name2-(2-methylprop-1-enyl)morpholine
PubChem CID67801913
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-(2-methylprop-1-enyl)morpholine
SMILESCC(C)=CC1CNCCO1
InChIInChI=1S/C8H15NO/c1-7(2)5-8-6-9-3-4-10-8/h5,8-9H,3-4,6H2,1-2H3
InChIKeyJRVIPZAVTNIGQQ-UHFFFAOYSA-N
XLogP0.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
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 2-(2-methylprop-1-enyl)morpholine?
The IUPAC name of 2-(2-methylprop-1-enyl)morpholine (CID 67801913) is 2-(2-methylprop-1-enyl)morpholine.
What is the SMILES notation for 2-(2-methylprop-1-enyl)morpholine?
The canonical SMILES for 2-(2-methylprop-1-enyl)morpholine is CC(C)=CC1CNCCO1.
What is the InChIKey of 2-(2-methylprop-1-enyl)morpholine?
The InChIKey is JRVIPZAVTNIGQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-7(2)5-8-6-9-3-4-10-8/h5,8-9H,3-4,6H2,1-2H3.
What are the key properties of 2-(2-methylprop-1-enyl)morpholine?
2-(2-methylprop-1-enyl)morpholine has a molecular weight of 141.21 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylprop-1-enyl)morpholine is sourced from PubChem (CID 67801913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).