4-[4-(furan-3-yl)butyl]morpholine

C12H19NO2 — CID 58736153

IUPAC4-[4-(furan-3-yl)butyl]morpholine
SMILESc1cc(CCCCN2CCOCC2)co1
InChIInChI=1S/C12H19NO2/c1(3-12-4-8-15-11-12)2-5-13-6-9-14-10-7-13/h4,8,11H,1-3,5-7,9-10H2
InChIKeyDGNHHWLBKOCYCT-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.93
Rot. Bonds5

About 4-[4-(furan-3-yl)butyl]morpholine

4-[4-(furan-3-yl)butyl]morpholine (PubChem CID 58736153) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 4-[4-(furan-3-yl)butyl]morpholine.

Molecular Properties

Compound Name4-[4-(furan-3-yl)butyl]morpholine
PubChem CID58736153
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name4-[4-(furan-3-yl)butyl]morpholine
SMILESc1cc(CCCCN2CCOCC2)co1
InChIInChI=1S/C12H19NO2/c1(3-12-4-8-15-11-12)2-5-13-6-9-14-10-7-13/h4,8,11H,1-3,5-7,9-10H2
InChIKeyDGNHHWLBKOCYCT-UHFFFAOYSA-N
XLogP1.93
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.93
H-Bond Donors ≤ 50
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 4-[4-(furan-3-yl)butyl]morpholine?
The IUPAC name of 4-[4-(furan-3-yl)butyl]morpholine (CID 58736153) is 4-[4-(furan-3-yl)butyl]morpholine.
What is the SMILES notation for 4-[4-(furan-3-yl)butyl]morpholine?
The canonical SMILES for 4-[4-(furan-3-yl)butyl]morpholine is c1cc(CCCCN2CCOCC2)co1.
What is the InChIKey of 4-[4-(furan-3-yl)butyl]morpholine?
The InChIKey is DGNHHWLBKOCYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1(3-12-4-8-15-11-12)2-5-13-6-9-14-10-7-13/h4,8,11H,1-3,5-7,9-10H2.
What are the key properties of 4-[4-(furan-3-yl)butyl]morpholine?
4-[4-(furan-3-yl)butyl]morpholine has a molecular weight of 209.29 g/mol, XLogP of 1.93, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(furan-3-yl)butyl]morpholine is sourced from PubChem (CID 58736153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).