2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol

C15H23NO2 — CID 142283504

IUPAC2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol
SMILESOCCN1CCC2(CCC3=CCCC=C3O2)CC1
InChIInChI=1S/C15H23NO2/c17-12-11-16-9-7-15(8-10-16)6-5-13-3-1-2-4-14(13)18-15/h3-4,17H,1-2,5-12H2
InChIKeyOWZGHDKENMUADZ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.23
Rot. Bonds2

About 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol

2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol (PubChem CID 142283504) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol.

Molecular Properties

Compound Name2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol
PubChem CID142283504
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol
SMILESOCCN1CCC2(CCC3=CCCC=C3O2)CC1
InChIInChI=1S/C15H23NO2/c17-12-11-16-9-7-15(8-10-16)6-5-13-3-1-2-4-14(13)18-15/h3-4,17H,1-2,5-12H2
InChIKeyOWZGHDKENMUADZ-UHFFFAOYSA-N
XLogP2.23
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol?
The IUPAC name of 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol (CID 142283504) is 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol.
What is the SMILES notation for 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol?
The canonical SMILES for 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol is OCCN1CCC2(CCC3=CCCC=C3O2)CC1.
What is the InChIKey of 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol?
The InChIKey is OWZGHDKENMUADZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c17-12-11-16-9-7-15(8-10-16)6-5-13-3-1-2-4-14(13)18-15/h3-4,17H,1-2,5-12H2.
What are the key properties of 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol?
2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol has a molecular weight of 249.35 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-spiro[3,4,6,7-tetrahydrochromene-2,4'-piperidine]-1'-ylethanol is sourced from PubChem (CID 142283504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).