5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine

C10H14FN3O — CID 169090115

IUPAC5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine
SMILESCOc1nc(N2CCCCC2)ncc1F
InChIInChI=1S/C10H14FN3O/c1-15-9-8(11)7-12-10(13-9)14-5-3-2-4-6-14/h7H,2-6H2,1H3
InChIKeyFIJGGBPWEPZQHE-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.61
Rot. Bonds2

About 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine

5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine (PubChem CID 169090115) has the molecular formula C10H14FN3O and a molecular weight of 211.24 g/mol. Its IUPAC name is 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine.

Molecular Properties

Compound Name5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine
PubChem CID169090115
Molecular FormulaC10H14FN3O
Molecular Weight211.24 g/mol
Exact Mass211.11
IUPAC Name5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine
SMILESCOc1nc(N2CCCCC2)ncc1F
InChIInChI=1S/C10H14FN3O/c1-15-9-8(11)7-12-10(13-9)14-5-3-2-4-6-14/h7H,2-6H2,1H3
InChIKeyFIJGGBPWEPZQHE-UHFFFAOYSA-N
XLogP1.61
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Chloro-5-fluoro-4-methoxypyrimidine
CID 13530704
5-Fluoro-2,4-dimethoxypyrimidine
CID 268774
5-Iodo-4-methoxypyrimidine
CID 10561760
2-Bromo-5-fluoro-4-methoxypyrimidine
CID 130649827
5-Fluoro-4-methoxy-2-methylsulfanylpyrimidine
CID 21602099
4-Methoxy-5-methylpyrimidine
CID 13861006
(1R,5S)-8-(5-fluoro-4-methoxypyrimidin-2-yl)-3-methoxy-8-azabicyclo[3.2.1]octane
CID 129614457
2-[4-(4-Ethylpiperazin-1-YL)piperidin-1-YL]-5-fluoro-4-methoxypyrimidine
CID 129616047
5-fluoro-4-methoxy-N-[[(2R)-1-propan-2-ylpyrrolidin-2-yl]methyl]pyrimidin-2-amine
CID 164630566
2,4-Dimethoxy-5-(trifluoromethyl)pyrimidine
CID 21732778
5-Fluoro-4-methoxypyrimidin-2-amine
CID 45080519
2-((5-Fluoropyrimidin-4-yl)oxy)-N,N-dimethylethanamine
CID 5151109

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine?
The IUPAC name of 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine (CID 169090115) is 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine.
What is the SMILES notation for 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine?
The canonical SMILES for 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine is COc1nc(N2CCCCC2)ncc1F.
What is the InChIKey of 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine?
The InChIKey is FIJGGBPWEPZQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O/c1-15-9-8(11)7-12-10(13-9)14-5-3-2-4-6-14/h7H,2-6H2,1H3.
What are the key properties of 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine?
5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine has a molecular weight of 211.24 g/mol, XLogP of 1.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-methoxy-2-piperidin-1-ylpyrimidine is sourced from PubChem (CID 169090115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).