1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol

C12H19NO3 — CID 79045813

IUPAC1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol
SMILESCC(C)(C(O)c1ccco1)N1CCOCC1
InChIInChI=1S/C12H19NO3/c1-12(2,13-5-8-15-9-6-13)11(14)10-4-3-7-16-10/h3-4,7,11,14H,5-6,8-9H2,1-2H3
InChIKeyOUOUZLVIJPUQGU-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.42
Rot. Bonds3

About 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol

1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol (PubChem CID 79045813) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol.

Molecular Properties

Compound Name1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol
PubChem CID79045813
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol
SMILESCC(C)(C(O)c1ccco1)N1CCOCC1
InChIInChI=1S/C12H19NO3/c1-12(2,13-5-8-15-9-6-13)11(14)10-4-3-7-16-10/h3-4,7,11,14H,5-6,8-9H2,1-2H3
InChIKeyOUOUZLVIJPUQGU-UHFFFAOYSA-N
XLogP1.42
TPSA45.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol?
The IUPAC name of 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol (CID 79045813) is 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol.
What is the SMILES notation for 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol?
The canonical SMILES for 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol is CC(C)(C(O)c1ccco1)N1CCOCC1.
What is the InChIKey of 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol?
The InChIKey is OUOUZLVIJPUQGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c1-12(2,13-5-8-15-9-6-13)11(14)10-4-3-7-16-10/h3-4,7,11,14H,5-6,8-9H2,1-2H3.
What are the key properties of 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol?
1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol has a molecular weight of 225.29 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-ol is sourced from PubChem (CID 79045813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).