spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol

C15H11NO3 — CID 123865823

IUPACspiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol
SMILESOc1ccc2c(c1)Oc1ccccc1C21COC=N1
InChIInChI=1S/C15H11NO3/c17-10-5-6-12-14(7-10)19-13-4-2-1-3-11(13)15(12)8-18-9-16-15/h1-7,9,17H,8H2
InChIKeyCOVZOPLCLVLFQN-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.80
Rot. Bonds

About spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol

spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol (PubChem CID 123865823) has the molecular formula C15H11NO3 and a molecular weight of 253.26 g/mol. Its IUPAC name is spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol.

Molecular Properties

Compound Namespiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol
PubChem CID123865823
Molecular FormulaC15H11NO3
Molecular Weight253.26 g/mol
Exact Mass253.07
IUPAC Namespiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol
SMILESOc1ccc2c(c1)Oc1ccccc1C21COC=N1
InChIInChI=1S/C15H11NO3/c17-10-5-6-12-14(7-10)19-13-4-2-1-3-11(13)15(12)8-18-9-16-15/h1-7,9,17H,8H2
InChIKeyCOVZOPLCLVLFQN-UHFFFAOYSA-N
XLogP2.80
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethylspiro[5H-1,3-oxazole-4,9'-xanthene]-2'-carboxamide
CID 68577084
spiro[2H-pyrano[3,2-b]chromene-10,4'-5H-1,3-oxazole]
CID 123661459
spiro[1H-2-benzofuran-3,9'-xanthene]-3',6'-diol
CID 21240933
cadmium;3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
CID 174867463
trisodium;3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one;hydride
CID 173284967
3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one;N,N-dimethylmethanamine
CID 174621018
3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one;phenol
CID 70117084
CID 87130951
CID 87130951
CID 57106395
CID 57106395
amino dihydrogen phosphite;3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
CID 174660209
3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one;ethanol
CID 66716560
acetic acid;3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-one
CID 2734982

Frequently Asked Questions

What is the IUPAC name of spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol?
The IUPAC name of spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol (CID 123865823) is spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol.
What is the SMILES notation for spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol?
The canonical SMILES for spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol is Oc1ccc2c(c1)Oc1ccccc1C21COC=N1.
What is the InChIKey of spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol?
The InChIKey is COVZOPLCLVLFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO3/c17-10-5-6-12-14(7-10)19-13-4-2-1-3-11(13)15(12)8-18-9-16-15/h1-7,9,17H,8H2.
What are the key properties of spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol?
spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol has a molecular weight of 253.26 g/mol, XLogP of 2.80, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[5H-1,3-oxazole-4,9'-xanthene]-3'-ol is sourced from PubChem (CID 123865823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).