4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine

C15H19N5O — CID 133314057

IUPAC4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
SMILESCOc1ccnc(N2CCN(c3cccc(C)n3)CC2)n1
InChIInChI=1S/C15H19N5O/c1-12-4-3-5-13(17-12)19-8-10-20(11-9-19)15-16-7-6-14(18-15)21-2/h3-7H,8-11H2,1-2H3
InChIKeyQMYKFIUNEDBYRA-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.52
Rot. Bonds3

About 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine

4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine (PubChem CID 133314057) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine.

Molecular Properties

Compound Name4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
PubChem CID133314057
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
SMILESCOc1ccnc(N2CCN(c3cccc(C)n3)CC2)n1
InChIInChI=1S/C15H19N5O/c1-12-4-3-5-13(17-12)19-8-10-20(11-9-19)15-16-7-6-14(18-15)21-2/h3-7H,8-11H2,1-2H3
InChIKeyQMYKFIUNEDBYRA-UHFFFAOYSA-N
XLogP1.52
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-6-methyl-2-pyrrolidin-1-ylpyrimidine
CID 154575579
2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine
CID 72890172
6-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2,3-dimethylimidazo[1,2-b]pyridazine
CID 163348421
4-[6-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 154575576
4-tert-butyl-6-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-2-methylpyrimidine
CID 154582519
8-(2-fluorophenyl)-2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]quinoline
CID 24733614
1-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine
CID 133313241
2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-5-methyl-1,3,4-thiadiazole
CID 146078262
2-[4-(3-ethoxy-2-pyridinyl)piperazin-1-yl]-4-methoxypyrimidine
CID 154772463
2-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]-6-propan-2-yloxypyrazine
CID 167897148
2-[4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]piperidin-1-yl]-4,6-dimethylpyrimidine
CID 24737031
4-methoxy-2-(4-propan-2-ylpiperidin-1-yl)pyrimidine
CID 166900843

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
The IUPAC name of 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine (CID 133314057) is 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine.
What is the SMILES notation for 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
The canonical SMILES for 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine is COc1ccnc(N2CCN(c3cccc(C)n3)CC2)n1.
What is the InChIKey of 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
The InChIKey is QMYKFIUNEDBYRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-12-4-3-5-13(17-12)19-8-10-20(11-9-19)15-16-7-6-14(18-15)21-2/h3-7H,8-11H2,1-2H3.
What are the key properties of 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine?
4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine has a molecular weight of 285.35 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine is sourced from PubChem (CID 133314057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).