4-phenyl-1-oxaspiro[4.4]non-3-en-2-one

C14H14O2 — CID 14006218

IUPAC4-phenyl-1-oxaspiro[4.4]non-3-en-2-one
SMILESO=C1C=C(c2ccccc2)C2(CCCC2)O1
InChIInChI=1S/C14H14O2/c15-13-10-12(11-6-2-1-3-7-11)14(16-13)8-4-5-9-14/h1-3,6-7,10H,4-5,8-9H2
InChIKeyFYBPRVHSPQNODR-UHFFFAOYSA-N
MW214.26 g/mol
LogP2.94
Rot. Bonds1

About 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one

4-phenyl-1-oxaspiro[4.4]non-3-en-2-one (PubChem CID 14006218) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one.

Molecular Properties

Compound Name4-phenyl-1-oxaspiro[4.4]non-3-en-2-one
PubChem CID14006218
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Name4-phenyl-1-oxaspiro[4.4]non-3-en-2-one
SMILESO=C1C=C(c2ccccc2)C2(CCCC2)O1
InChIInChI=1S/C14H14O2/c15-13-10-12(11-6-2-1-3-7-11)14(16-13)8-4-5-9-14/h1-3,6-7,10H,4-5,8-9H2
InChIKeyFYBPRVHSPQNODR-UHFFFAOYSA-N
XLogP2.94
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8-benzyl-4-(4-fluorophenyl)-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
CID 12832700
13-methyl-8-phenyl-11-oxa-13-azadispiro[4.1.47.25]tridec-8-ene-6,10,12-trione
CID 170913758
4-(benzylamino)-1-oxaspiro[4.5]dec-3-en-2-one
CID 684171
8-acetyl-4-(4-fluorophenyl)-1-oxa-8-azaspiro[4.5]dec-3-en-2-one
CID 12832694
3'-phenylspiro[cyclohexane-1,6'-furo[3,4-c][1,2]thiazole]-4'-one
CID 139095443
methyl 2-(2-methylpropanoyl)-5-oxo-3-phenylfuran-2-carboxylate
CID 135032131
4-piperidin-1-yl-1-oxaspiro[4.5]dec-3-en-2-one
CID 770244
3-(1-hydroxyethyl)-4-phenyl-1-oxaspiro[4.5]dec-3-en-2-one
CID 163360884
3-phenyl-4-prop-2-enyl-1-oxaspiro[4.5]dec-3-en-2-one
CID 134851738
2-methoxy-4-phenyl-1-oxaspiro[4.5]dec-3-ene
CID 162402238
methyl 2-oxo-1-oxaspiro[4.5]dec-3-ene-4-carboxylate
CID 46192660
2-methyl-3-phenyl-1,5-dioxaspiro[5.5]undec-2-en-4-one
CID 139662377

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one?
The IUPAC name of 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one (CID 14006218) is 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one.
What is the SMILES notation for 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one?
The canonical SMILES for 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one is O=C1C=C(c2ccccc2)C2(CCCC2)O1.
What is the InChIKey of 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one?
The InChIKey is FYBPRVHSPQNODR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c15-13-10-12(11-6-2-1-3-7-11)14(16-13)8-4-5-9-14/h1-3,6-7,10H,4-5,8-9H2.
What are the key properties of 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one?
4-phenyl-1-oxaspiro[4.4]non-3-en-2-one has a molecular weight of 214.26 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-oxaspiro[4.4]non-3-en-2-one is sourced from PubChem (CID 14006218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).