4-pent-3-en-2-ylmorpholine

C9H17NO — CID 3828336

IUPAC4-pent-3-en-2-ylmorpholine
SMILESCC=CC(C)N1CCOCC1
InChIInChI=1S/C9H17NO/c1-3-4-9(2)10-5-7-11-8-6-10/h3-4,9H,5-8H2,1-2H3
InChIKeyFDTFLOVXONQJFU-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.28
Rot. Bonds2

About 4-pent-3-en-2-ylmorpholine

4-pent-3-en-2-ylmorpholine (PubChem CID 3828336) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 4-pent-3-en-2-ylmorpholine.

Molecular Properties

Compound Name4-pent-3-en-2-ylmorpholine
PubChem CID3828336
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name4-pent-3-en-2-ylmorpholine
SMILESCC=CC(C)N1CCOCC1
InChIInChI=1S/C9H17NO/c1-3-4-9(2)10-5-7-11-8-6-10/h3-4,9H,5-8H2,1-2H3
InChIKeyFDTFLOVXONQJFU-UHFFFAOYSA-N
XLogP1.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-pent-3-en-2-ylmorpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-pent-3-en-2-ylmorpholine?
The IUPAC name of 4-pent-3-en-2-ylmorpholine (CID 3828336) is 4-pent-3-en-2-ylmorpholine.
What is the SMILES notation for 4-pent-3-en-2-ylmorpholine?
The canonical SMILES for 4-pent-3-en-2-ylmorpholine is CC=CC(C)N1CCOCC1.
What is the InChIKey of 4-pent-3-en-2-ylmorpholine?
The InChIKey is FDTFLOVXONQJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-3-4-9(2)10-5-7-11-8-6-10/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 4-pent-3-en-2-ylmorpholine?
4-pent-3-en-2-ylmorpholine has a molecular weight of 155.24 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pent-3-en-2-ylmorpholine is sourced from PubChem (CID 3828336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).