2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol

C15H17NO3 — CID 117401768

IUPAC2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol
SMILESCc1cc2c(C(N)CO)c3oc(C)cc3c(C)c2o1
InChIInChI=1S/C15H17NO3/c1-7-4-10-9(3)14-11(5-8(2)18-14)13(12(16)6-17)15(10)19-7/h4-5,12,17H,6,16H2,1-3H3
InChIKeyBTPWXOJSHJQTGL-UHFFFAOYSA-N
MW259.30 g/mol
LogP3.10
Rot. Bonds2

About 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol

2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol (PubChem CID 117401768) has the molecular formula C15H17NO3 and a molecular weight of 259.30 g/mol. Its IUPAC name is 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol
PubChem CID117401768
Molecular FormulaC15H17NO3
Molecular Weight259.30 g/mol
Exact Mass259.12
IUPAC Name2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol
SMILESCc1cc2c(C(N)CO)c3oc(C)cc3c(C)c2o1
InChIInChI=1S/C15H17NO3/c1-7-4-10-9(3)14-11(5-8(2)18-14)13(12(16)6-17)15(10)19-7/h4-5,12,17H,6,16H2,1-3H3
InChIKeyBTPWXOJSHJQTGL-UHFFFAOYSA-N
XLogP3.10
TPSA72.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.30
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol 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 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol?
The IUPAC name of 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol (CID 117401768) is 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol.
What is the SMILES notation for 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol?
The canonical SMILES for 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol is Cc1cc2c(C(N)CO)c3oc(C)cc3c(C)c2o1.
What is the InChIKey of 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol?
The InChIKey is BTPWXOJSHJQTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-7-4-10-9(3)14-11(5-8(2)18-14)13(12(16)6-17)15(10)19-7/h4-5,12,17H,6,16H2,1-3H3.
What are the key properties of 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol?
2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol has a molecular weight of 259.30 g/mol, XLogP of 3.10, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)ethanol is sourced from PubChem (CID 117401768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).