4-spiro[chromene-2,4'-piperidine]-4-ylphenol

C19H19NO2 — CID 25129433

IUPAC4-spiro[chromene-2,4'-piperidine]-4-ylphenol
SMILESOc1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cc1
InChIInChI=1S/C19H19NO2/c21-15-7-5-14(6-8-15)17-13-19(9-11-20-12-10-19)22-18-4-2-1-3-16(17)18/h1-8,13,20-21H,9-12H2
InChIKeyOZOVJRMTVPPLSS-UHFFFAOYSA-N
MW293.37 g/mol
LogP3.34
Rot. Bonds1

About 4-spiro[chromene-2,4'-piperidine]-4-ylphenol

4-spiro[chromene-2,4'-piperidine]-4-ylphenol (PubChem CID 25129433) has the molecular formula C19H19NO2 and a molecular weight of 293.37 g/mol. Its IUPAC name is 4-spiro[chromene-2,4'-piperidine]-4-ylphenol.

Molecular Properties

Compound Name4-spiro[chromene-2,4'-piperidine]-4-ylphenol
PubChem CID25129433
Molecular FormulaC19H19NO2
Molecular Weight293.37 g/mol
Exact Mass293.14
IUPAC Name4-spiro[chromene-2,4'-piperidine]-4-ylphenol
SMILESOc1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cc1
InChIInChI=1S/C19H19NO2/c21-15-7-5-14(6-8-15)17-13-19(9-11-20-12-10-19)22-18-4-2-1-3-16(17)18/h1-8,13,20-21H,9-12H2
InChIKeyOZOVJRMTVPPLSS-UHFFFAOYSA-N
XLogP3.34
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-spiro[chromene-2,4'-piperidine]-4-ylphenol?
The IUPAC name of 4-spiro[chromene-2,4'-piperidine]-4-ylphenol (CID 25129433) is 4-spiro[chromene-2,4'-piperidine]-4-ylphenol.
What is the SMILES notation for 4-spiro[chromene-2,4'-piperidine]-4-ylphenol?
The canonical SMILES for 4-spiro[chromene-2,4'-piperidine]-4-ylphenol is Oc1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cc1.
What is the InChIKey of 4-spiro[chromene-2,4'-piperidine]-4-ylphenol?
The InChIKey is OZOVJRMTVPPLSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO2/c21-15-7-5-14(6-8-15)17-13-19(9-11-20-12-10-19)22-18-4-2-1-3-16(17)18/h1-8,13,20-21H,9-12H2.
What are the key properties of 4-spiro[chromene-2,4'-piperidine]-4-ylphenol?
4-spiro[chromene-2,4'-piperidine]-4-ylphenol has a molecular weight of 293.37 g/mol, XLogP of 3.34, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-spiro[chromene-2,4'-piperidine]-4-ylphenol is sourced from PubChem (CID 25129433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).