2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen

C8H10FNO — CID 143770915

IUPAC2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen
SMILESC=C1C=CC(=O)NC12CC2F.[H][H]
InChIInChI=1S/C8H8FNO.H2/c1-5-2-3-7(11)10-8(5)4-6(8)9;/h2-3,6H,1,4H2,(H,10,11);1H
InChIKeyHEDHIELASUXDNB-UHFFFAOYSA-N
MW155.17 g/mol
LogP0.96
Rot. Bonds

About 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen

2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen (PubChem CID 143770915) has the molecular formula C8H10FNO and a molecular weight of 155.17 g/mol. Its IUPAC name is 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen.

Molecular Properties

Compound Name2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen
PubChem CID143770915
Molecular FormulaC8H10FNO
Molecular Weight155.17 g/mol
Exact Mass155.07
IUPAC Name2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen
SMILESC=C1C=CC(=O)NC12CC2F.[H][H]
InChIInChI=1S/C8H8FNO.H2/c1-5-2-3-7(11)10-8(5)4-6(8)9;/h2-3,6H,1,4H2,(H,10,11);1H
InChIKeyHEDHIELASUXDNB-UHFFFAOYSA-N
XLogP0.96
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.17
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen?
The IUPAC name of 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen (CID 143770915) is 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen.
What is the SMILES notation for 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen?
The canonical SMILES for 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen is C=C1C=CC(=O)NC12CC2F.[H][H].
What is the InChIKey of 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen?
The InChIKey is HEDHIELASUXDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FNO.H2/c1-5-2-3-7(11)10-8(5)4-6(8)9;/h2-3,6H,1,4H2,(H,10,11);1H.
What are the key properties of 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen?
2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen has a molecular weight of 155.17 g/mol, XLogP of 0.96, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-8-methylidene-4-azaspiro[2.5]oct-6-en-5-one;molecular hydrogen is sourced from PubChem (CID 143770915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).