5-fluoro-6-methylidene-1,3-diazinane-2,4-dione

C5H5FN2O2 — CID 130188362

IUPAC5-fluoro-6-methylidene-1,3-diazinane-2,4-dione
SMILESC=C1NC(=O)NC(=O)C1F
InChIInChI=1S/C5H5FN2O2/c1-2-3(6)4(9)8-5(10)7-2/h3H,1H2,(H2,7,8,9,10)
InChIKeyPMVIABRGQUXIEH-UHFFFAOYSA-N
MW144.10 g/mol
LogP-0.32
Rot. Bonds

About 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione

5-fluoro-6-methylidene-1,3-diazinane-2,4-dione (PubChem CID 130188362) has the molecular formula C5H5FN2O2 and a molecular weight of 144.10 g/mol. Its IUPAC name is 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione.

Molecular Properties

Compound Name5-fluoro-6-methylidene-1,3-diazinane-2,4-dione
PubChem CID130188362
Molecular FormulaC5H5FN2O2
Molecular Weight144.10 g/mol
Exact Mass144.03
IUPAC Name5-fluoro-6-methylidene-1,3-diazinane-2,4-dione
SMILESC=C1NC(=O)NC(=O)C1F
InChIInChI=1S/C5H5FN2O2/c1-2-3(6)4(9)8-5(10)7-2/h3H,1H2,(H2,7,8,9,10)
InChIKeyPMVIABRGQUXIEH-UHFFFAOYSA-N
XLogP-0.32
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.10
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione?
The IUPAC name of 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione (CID 130188362) is 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione.
What is the SMILES notation for 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione?
The canonical SMILES for 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione is C=C1NC(=O)NC(=O)C1F.
What is the InChIKey of 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione?
The InChIKey is PMVIABRGQUXIEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FN2O2/c1-2-3(6)4(9)8-5(10)7-2/h3H,1H2,(H2,7,8,9,10).
What are the key properties of 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione?
5-fluoro-6-methylidene-1,3-diazinane-2,4-dione has a molecular weight of 144.10 g/mol, XLogP of -0.32, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-6-methylidene-1,3-diazinane-2,4-dione is sourced from PubChem (CID 130188362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).