4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine

C16H20N4O2 — CID 166605974

IUPAC4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine
SMILESCOc1cc(N2CCC(COc3ccccn3)CC2)ncn1
InChIInChI=1S/C16H20N4O2/c1-21-16-10-14(18-12-19-16)20-8-5-13(6-9-20)11-22-15-4-2-3-7-17-15/h2-4,7,10,12-13H,5-6,8-9,11H2,1H3
InChIKeyPQMYXXWSCHYYCQ-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.18
Rot. Bonds5

About 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine

4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine (PubChem CID 166605974) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine.

Molecular Properties

Compound Name4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine
PubChem CID166605974
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine
SMILESCOc1cc(N2CCC(COc3ccccn3)CC2)ncn1
InChIInChI=1S/C16H20N4O2/c1-21-16-10-14(18-12-19-16)20-8-5-13(6-9-20)11-22-15-4-2-3-7-17-15/h2-4,7,10,12-13H,5-6,8-9,11H2,1H3
InChIKeyPQMYXXWSCHYYCQ-UHFFFAOYSA-N
XLogP2.18
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidin-4-one
CID 126874409
2-methyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazine
CID 126874169
2-fluoro-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyridine
CID 133349592
2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]quinoline
CID 133349552
2-methylsulfanyl-4-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine
CID 166605956
3-methylsulfanyl-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyridazine
CID 133349542
(8R)-2-(6-methoxypyrimidin-4-yl)-8-(pyridin-2-yloxymethyl)-5-oxa-2-azaspiro[3.4]octane
CID 124795040
6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrido[2,3-b]pyrazine
CID 126874369
6-methoxy-1-methyl-4-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]-2,3-dihydroindole
CID 175932420
1-methyl-4-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrazolo[5,4-d]pyrimidine
CID 126874144
1-[4-methoxy-2-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]phenyl]-2,2-dimethylpropan-1-one
CID 175922233
[1-(6-methoxypyrimidin-4-yl)pyrrolidin-3-yl]methanamine
CID 66320781

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine?
The IUPAC name of 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine (CID 166605974) is 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine.
What is the SMILES notation for 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine?
The canonical SMILES for 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine is COc1cc(N2CCC(COc3ccccn3)CC2)ncn1.
What is the InChIKey of 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine?
The InChIKey is PQMYXXWSCHYYCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-21-16-10-14(18-12-19-16)20-8-5-13(6-9-20)11-22-15-4-2-3-7-17-15/h2-4,7,10,12-13H,5-6,8-9,11H2,1H3.
What are the key properties of 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine?
4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine has a molecular weight of 300.36 g/mol, XLogP of 2.18, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-[4-(pyridin-2-yloxymethyl)piperidin-1-yl]pyrimidine is sourced from PubChem (CID 166605974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).