2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol

C13H15NO — CID 23346457

IUPAC2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol
SMILESNCC(O)C1=CC2(CC2)c2ccccc21
InChIInChI=1S/C13H15NO/c14-8-12(15)10-7-13(5-6-13)11-4-2-1-3-9(10)11/h1-4,7,12,15H,5-6,8,14H2
InChIKeyJEAGKESHGLKHGV-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.43
Rot. Bonds2

About 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol

2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol (PubChem CID 23346457) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol.

Molecular Properties

Compound Name2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol
PubChem CID23346457
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol
SMILESNCC(O)C1=CC2(CC2)c2ccccc21
InChIInChI=1S/C13H15NO/c14-8-12(15)10-7-13(5-6-13)11-4-2-1-3-9(10)11/h1-4,7,12,15H,5-6,8,14H2
InChIKeyJEAGKESHGLKHGV-UHFFFAOYSA-N
XLogP1.43
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol?
The IUPAC name of 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol (CID 23346457) is 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol.
What is the SMILES notation for 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol?
The canonical SMILES for 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol is NCC(O)C1=CC2(CC2)c2ccccc21.
What is the InChIKey of 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol?
The InChIKey is JEAGKESHGLKHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c14-8-12(15)10-7-13(5-6-13)11-4-2-1-3-9(10)11/h1-4,7,12,15H,5-6,8,14H2.
What are the key properties of 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol?
2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol has a molecular weight of 201.27 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-spiro[cyclopropane-1,3'-indene]-1'-ylethanol is sourced from PubChem (CID 23346457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).