6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione

C8H6FN3O3 — CID 141311434

IUPAC6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione
SMILESCOc1nc2[nH]c(=O)[nH]c(=O)c2cc1F
InChIInChI=1S/C8H6FN3O3/c1-15-7-4(9)2-3-5(10-7)11-8(14)12-6(3)13/h2H,1H3,(H2,10,11,12,13,14)
InChIKeyJALMZXISLDKJEG-UHFFFAOYSA-N
MW211.15 g/mol
LogP-0.24
Rot. Bonds1

About 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione

6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 141311434) has the molecular formula C8H6FN3O3 and a molecular weight of 211.15 g/mol. Its IUPAC name is 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID141311434
Molecular FormulaC8H6FN3O3
Molecular Weight211.15 g/mol
Exact Mass211.04
IUPAC Name6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione
SMILESCOc1nc2[nH]c(=O)[nH]c(=O)c2cc1F
InChIInChI=1S/C8H6FN3O3/c1-15-7-4(9)2-3-5(10-7)11-8(14)12-6(3)13/h2H,1H3,(H2,10,11,12,13,14)
InChIKeyJALMZXISLDKJEG-UHFFFAOYSA-N
XLogP-0.24
TPSA87.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.15
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione (CID 141311434) is 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione is COc1nc2[nH]c(=O)[nH]c(=O)c2cc1F.
What is the InChIKey of 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is JALMZXISLDKJEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FN3O3/c1-15-7-4(9)2-3-5(10-7)11-8(14)12-6(3)13/h2H,1H3,(H2,10,11,12,13,14).
What are the key properties of 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione?
6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 211.15 g/mol, XLogP of -0.24, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-7-methoxy-1H-pyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 141311434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).