4-(2,2,5,5-tetramethylfuran-3-yl)morpholine

C12H21NO2 — CID 90241021

IUPAC4-(2,2,5,5-tetramethylfuran-3-yl)morpholine
SMILESCC1(C)C=C(N2CCOCC2)C(C)(C)O1
InChIInChI=1S/C12H21NO2/c1-11(2)9-10(12(3,4)15-11)13-5-7-14-8-6-13/h9H,5-8H2,1-4H3
InChIKeyBEJDIASHGZHAAQ-UHFFFAOYSA-N
MW211.30 g/mol
LogP1.79
Rot. Bonds1

About 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine

4-(2,2,5,5-tetramethylfuran-3-yl)morpholine (PubChem CID 90241021) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine.

Molecular Properties

Compound Name4-(2,2,5,5-tetramethylfuran-3-yl)morpholine
PubChem CID90241021
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name4-(2,2,5,5-tetramethylfuran-3-yl)morpholine
SMILESCC1(C)C=C(N2CCOCC2)C(C)(C)O1
InChIInChI=1S/C12H21NO2/c1-11(2)9-10(12(3,4)15-11)13-5-7-14-8-6-13/h9H,5-8H2,1-4H3
InChIKeyBEJDIASHGZHAAQ-UHFFFAOYSA-N
XLogP1.79
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine 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-(2,2,5,5-tetramethylfuran-3-yl)morpholine?
The IUPAC name of 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine (CID 90241021) is 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine.
What is the SMILES notation for 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine?
The canonical SMILES for 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine is CC1(C)C=C(N2CCOCC2)C(C)(C)O1.
What is the InChIKey of 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine?
The InChIKey is BEJDIASHGZHAAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-11(2)9-10(12(3,4)15-11)13-5-7-14-8-6-13/h9H,5-8H2,1-4H3.
What are the key properties of 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine?
4-(2,2,5,5-tetramethylfuran-3-yl)morpholine has a molecular weight of 211.30 g/mol, XLogP of 1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2,5,5-tetramethylfuran-3-yl)morpholine is sourced from PubChem (CID 90241021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).