5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine

C15H16FN3O — CID 117231387

IUPAC5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine
SMILESFc1ccccc1Oc1cnc(C2CCCNC2)nc1
InChIInChI=1S/C15H16FN3O/c16-13-5-1-2-6-14(13)20-12-9-18-15(19-10-12)11-4-3-7-17-8-11/h1-2,5-6,9-11,17H,3-4,7-8H2
InChIKeySEYLJUOSMICPNC-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.88
Rot. Bonds3

About 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine

5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine (PubChem CID 117231387) has the molecular formula C15H16FN3O and a molecular weight of 273.31 g/mol. Its IUPAC name is 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine.

Molecular Properties

Compound Name5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine
PubChem CID117231387
Molecular FormulaC15H16FN3O
Molecular Weight273.31 g/mol
Exact Mass273.13
IUPAC Name5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine
SMILESFc1ccccc1Oc1cnc(C2CCCNC2)nc1
InChIInChI=1S/C15H16FN3O/c16-13-5-1-2-6-14(13)20-12-9-18-15(19-10-12)11-4-3-7-17-8-11/h1-2,5-6,9-11,17H,3-4,7-8H2
InChIKeySEYLJUOSMICPNC-UHFFFAOYSA-N
XLogP2.88
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azetidin-3-yl)-5-(2-fluorophenoxy)pyrimidine
CID 117231373
5-(3-methoxyphenoxy)-2-piperidin-3-ylpyrimidine
CID 117231461
5-(3-methylphenoxy)-2-piperidin-3-ylpyrimidine
CID 117231457
3-[5-(3-methylphenoxy)pyrimidin-2-yl]azepane
CID 117231462
2-[(3R)-piperidin-3-yl]pyrimidine
CID 86328129
3-[4-(2-fluorophenoxy)pyrazol-1-yl]azepane
CID 117124986
2-piperidin-3-ylpyrimidin-5-ol
CID 117231651
5-(2-methylphenoxy)-2-piperidin-4-ylpyrimidine
CID 117231365
difluoromethane;3-[(2-fluorophenoxy)methyl]piperidine
CID 166104221
5-(2-fluorophenoxy)-2-piperidin-1-ylpyrimidine
CID 161189658
5-(2,6-difluorophenyl)-3-piperidin-3-yl-1,2,4-oxadiazole
CID 63024920
3-[5-(2,6-difluorophenyl)-1H-imidazol-2-yl]piperidine
CID 43650985

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine?
The IUPAC name of 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine (CID 117231387) is 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine.
What is the SMILES notation for 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine?
The canonical SMILES for 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine is Fc1ccccc1Oc1cnc(C2CCCNC2)nc1.
What is the InChIKey of 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine?
The InChIKey is SEYLJUOSMICPNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN3O/c16-13-5-1-2-6-14(13)20-12-9-18-15(19-10-12)11-4-3-7-17-8-11/h1-2,5-6,9-11,17H,3-4,7-8H2.
What are the key properties of 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine?
5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine has a molecular weight of 273.31 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluorophenoxy)-2-piperidin-3-ylpyrimidine is sourced from PubChem (CID 117231387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).