6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one

C11H11NO3 — CID 121207071

IUPAC6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one
SMILESO=C1CC2(CNC2)Oc2ccc(O)cc21
InChIInChI=1S/C11H11NO3/c13-7-1-2-10-8(3-7)9(14)4-11(15-10)5-12-6-11/h1-3,12-13H,4-6H2
InChIKeyIAIKIBLOSLMRLP-UHFFFAOYSA-N
MW205.21 g/mol
LogP0.70
Rot. Bonds

About 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one

6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one (PubChem CID 121207071) has the molecular formula C11H11NO3 and a molecular weight of 205.21 g/mol. Its IUPAC name is 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one.

Molecular Properties

Compound Name6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one
PubChem CID121207071
Molecular FormulaC11H11NO3
Molecular Weight205.21 g/mol
Exact Mass205.07
IUPAC Name6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one
SMILESO=C1CC2(CNC2)Oc2ccc(O)cc21
InChIInChI=1S/C11H11NO3/c13-7-1-2-10-8(3-7)9(14)4-11(15-10)5-12-6-11/h1-3,12-13H,4-6H2
InChIKeyIAIKIBLOSLMRLP-UHFFFAOYSA-N
XLogP0.70
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.21
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-fluorospiro[3H-chromene-2,3'-azetidine]-4-one
CID 121207087
6-hydroxyspiro[3H-chromene-2,1'-cyclohexane]-4-one
CID 3243908
6-methoxyspiro[3H-chromene-2,3'-azetidine]-4-one
CID 121207107
6-hydroxy-2-methoxy-2-phenyl-3H-chromen-4-one
CID 174473612
6-fluorospiro[3H-chromene-2,4'-piperidine]-4-one;hydrochloride
CID 68663303
6-hydroxy-2-(3-hydroxybutyl)-2-methyl-3H-chromen-4-one
CID 155550976
6-hydroxy-2-(10-hydroxydecyl)-2-methyl-3H-chromen-4-one;6-hydroxy-2-(14-hydroxytetradecyl)-2-methyl-3H-chromen-4-one;6-hydroxy-2-(13-hydroxytridecyl)-2-methyl-3H-chromen-4-one;6-hydroxy-2-(11-hydroxyundecyl)-2-methyl-3H-chromen-4-one
CID 173079143
(2S)-6-hydroxy-2-(12-hydroxydodecyl)-2-methyl-3H-chromen-4-one
CID 67533788
6-phenylmethoxyspiro[3H-chromene-2,3'-pyrrolidine]-4-one
CID 82045706
6'-bromospiro[1,3-dihydroindene-2,2'-3H-chromene]-4'-one
CID 58423986
(4-oxospiro[3H-chromene-2,4'-piperidine]-6-yl)carbamic acid
CID 68984003
6-(trifluoromethyl)spiro[3H-chromene-2,4'-piperidine]-4-one;hydrochloride
CID 68663844

Frequently Asked Questions

What is the IUPAC name of 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one?
The IUPAC name of 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one (CID 121207071) is 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one.
What is the SMILES notation for 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one?
The canonical SMILES for 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one is O=C1CC2(CNC2)Oc2ccc(O)cc21.
What is the InChIKey of 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one?
The InChIKey is IAIKIBLOSLMRLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO3/c13-7-1-2-10-8(3-7)9(14)4-11(15-10)5-12-6-11/h1-3,12-13H,4-6H2.
What are the key properties of 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one?
6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one has a molecular weight of 205.21 g/mol, XLogP of 0.70, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxyspiro[3H-chromene-2,3'-azetidine]-4-one is sourced from PubChem (CID 121207071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).