3-[2-(oxolan-3-ylidene)propyl]morpholine

C11H19NO2 — CID 104855445

IUPAC3-[2-(oxolan-3-ylidene)propyl]morpholine
SMILESCC(CC1COCCN1)=C1CCOC1
InChIInChI=1S/C11H19NO2/c1-9(10-2-4-13-7-10)6-11-8-14-5-3-12-11/h11-12H,2-8H2,1H3
InChIKeyHHGJFGWOZLEWEI-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.10
Rot. Bonds2

About 3-[2-(oxolan-3-ylidene)propyl]morpholine

3-[2-(oxolan-3-ylidene)propyl]morpholine (PubChem CID 104855445) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-[2-(oxolan-3-ylidene)propyl]morpholine.

Molecular Properties

Compound Name3-[2-(oxolan-3-ylidene)propyl]morpholine
PubChem CID104855445
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name3-[2-(oxolan-3-ylidene)propyl]morpholine
SMILESCC(CC1COCCN1)=C1CCOC1
InChIInChI=1S/C11H19NO2/c1-9(10-2-4-13-7-10)6-11-8-14-5-3-12-11/h11-12H,2-8H2,1H3
InChIKeyHHGJFGWOZLEWEI-UHFFFAOYSA-N
XLogP1.10
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 3-[2-(oxolan-3-ylidene)propyl]morpholine?
The IUPAC name of 3-[2-(oxolan-3-ylidene)propyl]morpholine (CID 104855445) is 3-[2-(oxolan-3-ylidene)propyl]morpholine.
What is the SMILES notation for 3-[2-(oxolan-3-ylidene)propyl]morpholine?
The canonical SMILES for 3-[2-(oxolan-3-ylidene)propyl]morpholine is CC(CC1COCCN1)=C1CCOC1.
What is the InChIKey of 3-[2-(oxolan-3-ylidene)propyl]morpholine?
The InChIKey is HHGJFGWOZLEWEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-9(10-2-4-13-7-10)6-11-8-14-5-3-12-11/h11-12H,2-8H2,1H3.
What are the key properties of 3-[2-(oxolan-3-ylidene)propyl]morpholine?
3-[2-(oxolan-3-ylidene)propyl]morpholine has a molecular weight of 197.28 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(oxolan-3-ylidene)propyl]morpholine is sourced from PubChem (CID 104855445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).