fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one

C8H11FmNO3 — CID 135731613

IUPACfermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one
SMILESCC1CCCC12N=C(O)OC2=O.[Fm]
InChIInChI=1S/C8H11NO3.Fm/c1-5-3-2-4-8(5)6(10)12-7(11)9-8;/h5H,2-4H2,1H3,(H,9,11);
InChIKeyKLAPPERWYOFGBW-UHFFFAOYSA-N
MW426.18 g/mol
LogP1.02
Rot. Bonds

About fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one

fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one (PubChem CID 135731613) has the molecular formula C8H11FmNO3 and a molecular weight of 426.18 g/mol. Its IUPAC name is fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one.

Molecular Properties

Compound Namefermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one
PubChem CID135731613
Molecular FormulaC8H11FmNO3
Molecular Weight426.18 g/mol
Exact Mass426.17
IUPAC Namefermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one
SMILESCC1CCCC12N=C(O)OC2=O.[Fm]
InChIInChI=1S/C8H11NO3.Fm/c1-5-3-2-4-8(5)6(10)12-7(11)9-8;/h5H,2-4H2,1H3,(H,9,11);
InChIKeyKLAPPERWYOFGBW-UHFFFAOYSA-N
XLogP1.02
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.18
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one?
The IUPAC name of fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one (CID 135731613) is fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one.
What is the SMILES notation for fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one?
The canonical SMILES for fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one is CC1CCCC12N=C(O)OC2=O.[Fm].
What is the InChIKey of fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one?
The InChIKey is KLAPPERWYOFGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3.Fm/c1-5-3-2-4-8(5)6(10)12-7(11)9-8;/h5H,2-4H2,1H3,(H,9,11);.
What are the key properties of fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one?
fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one has a molecular weight of 426.18 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fermium;2-hydroxy-9-methyl-3-oxa-1-azaspiro[4.4]non-1-en-4-one is sourced from PubChem (CID 135731613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).