5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine

C15H18N4O — CID 51040288

IUPAC5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine
SMILESCOc1cnc(-c2ccccn2)nc1N1CCCCC1
InChIInChI=1S/C15H18N4O/c1-20-13-11-17-14(12-7-3-4-8-16-12)18-15(13)19-9-5-2-6-10-19/h3-4,7-8,11H,2,5-6,9-10H2,1H3
InChIKeyUJYKMIQVKUODIS-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.54
Rot. Bonds3

About 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine

5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine (PubChem CID 51040288) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine
PubChem CID51040288
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine
SMILESCOc1cnc(-c2ccccn2)nc1N1CCCCC1
InChIInChI=1S/C15H18N4O/c1-20-13-11-17-14(12-7-3-4-8-16-12)18-15(13)19-9-5-2-6-10-19/h3-4,7-8,11H,2,5-6,9-10H2,1H3
InChIKeyUJYKMIQVKUODIS-UHFFFAOYSA-N
XLogP2.54
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine?
The IUPAC name of 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine (CID 51040288) is 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine.
What is the SMILES notation for 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine?
The canonical SMILES for 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine is COc1cnc(-c2ccccn2)nc1N1CCCCC1.
What is the InChIKey of 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine?
The InChIKey is UJYKMIQVKUODIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-20-13-11-17-14(12-7-3-4-8-16-12)18-15(13)19-9-5-2-6-10-19/h3-4,7-8,11H,2,5-6,9-10H2,1H3.
What are the key properties of 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine?
5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine has a molecular weight of 270.34 g/mol, XLogP of 2.54, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-piperidin-1-yl-2-pyridin-2-ylpyrimidine is sourced from PubChem (CID 51040288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).