7-fluoro-4H-pyrido[1,2-a]pyrimidine

C8H7FN2 — CID 169220442

IUPAC7-fluoro-4H-pyrido[1,2-a]pyrimidine
SMILESFC1=CN2CC=CN=C2C=C1
InChIInChI=1S/C8H7FN2/c9-7-2-3-8-10-4-1-5-11(8)6-7/h1-4,6H,5H2
InChIKeyICNMFDZESJERFH-UHFFFAOYSA-N
MW150.16 g/mol
LogP1.59
Rot. Bonds

About 7-fluoro-4H-pyrido[1,2-a]pyrimidine

7-fluoro-4H-pyrido[1,2-a]pyrimidine (PubChem CID 169220442) has the molecular formula C8H7FN2 and a molecular weight of 150.16 g/mol. Its IUPAC name is 7-fluoro-4H-pyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Name7-fluoro-4H-pyrido[1,2-a]pyrimidine
PubChem CID169220442
Molecular FormulaC8H7FN2
Molecular Weight150.16 g/mol
Exact Mass150.06
IUPAC Name7-fluoro-4H-pyrido[1,2-a]pyrimidine
SMILESFC1=CN2CC=CN=C2C=C1
InChIInChI=1S/C8H7FN2/c9-7-2-3-8-10-4-1-5-11(8)6-7/h1-4,6H,5H2
InChIKeyICNMFDZESJERFH-UHFFFAOYSA-N
XLogP1.59
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.16
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-Trifluoromethylpyrido[1,2-a]-[1,3,5]triazin-2-one
CID 129751111
2,6,13-Triazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
CID 12404659
Pyrido[1,2-a]pyrimidine
CID 20094215
2h-Pyrido-[1,2-a]pyrimidine
CID 20222720
3,4-Dihydro-2h-pyrido[1,2-a]pyrimidine
CID 21111582
Pyrimido[1,6-a]pyrimidine
CID 68595774
4h-Pyrido[1,2-a]pyrimidine-4-imine
CID 129744803
2h-Pyrido[1,2-a]-pyrimidine-2-imine
CID 129745249
2h-Pyrido[1,2-a][1,3,5]triazine
CID 129879268
2,13-Diazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene
CID 135082283
Aminopyrido[1,2-a]pyrimidine
CID 138376774
4-methyl-2,2-bis(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine
CID 5226153

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4H-pyrido[1,2-a]pyrimidine?
The IUPAC name of 7-fluoro-4H-pyrido[1,2-a]pyrimidine (CID 169220442) is 7-fluoro-4H-pyrido[1,2-a]pyrimidine.
What is the SMILES notation for 7-fluoro-4H-pyrido[1,2-a]pyrimidine?
The canonical SMILES for 7-fluoro-4H-pyrido[1,2-a]pyrimidine is FC1=CN2CC=CN=C2C=C1.
What is the InChIKey of 7-fluoro-4H-pyrido[1,2-a]pyrimidine?
The InChIKey is ICNMFDZESJERFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN2/c9-7-2-3-8-10-4-1-5-11(8)6-7/h1-4,6H,5H2.
What are the key properties of 7-fluoro-4H-pyrido[1,2-a]pyrimidine?
7-fluoro-4H-pyrido[1,2-a]pyrimidine has a molecular weight of 150.16 g/mol, XLogP of 1.59, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4H-pyrido[1,2-a]pyrimidine is sourced from PubChem (CID 169220442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).