2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine

C19H20N6 — CID 72890172

IUPAC2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine
SMILESCc1cccc(N2CCN(c3nccc(-c4ccccn4)n3)CC2)n1
InChIInChI=1S/C19H20N6/c1-15-5-4-7-18(22-15)24-11-13-25(14-12-24)19-21-10-8-17(23-19)16-6-2-3-9-20-16/h2-10H,11-14H2,1H3
InChIKeyCWPNTRCAERUQLB-UHFFFAOYSA-N
MW332.41 g/mol
LogP2.57
Rot. Bonds3

About 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine

2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine (PubChem CID 72890172) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine.

Molecular Properties

Compound Name2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine
PubChem CID72890172
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC Name2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine
SMILESCc1cccc(N2CCN(c3nccc(-c4ccccn4)n3)CC2)n1
InChIInChI=1S/C19H20N6/c1-15-5-4-7-18(22-15)24-11-13-25(14-12-24)19-21-10-8-17(23-19)16-6-2-3-9-20-16/h2-10H,11-14H2,1H3
InChIKeyCWPNTRCAERUQLB-UHFFFAOYSA-N
XLogP2.57
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-(6-methyl-2-pyridinyl)-4-pyridin-2-ylpiperazine
CID 133313241
4-methoxy-2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]pyrimidine
CID 133314057
4,5-dimethyl-6-[4-(4-pyridin-2-ylpyrimidin-2-yl)piperazin-1-yl]pyrimidine
CID 163352081
2-[4-(4-pyridin-2-ylpyrimidin-2-yl)piperazin-1-yl]-1,3,4-thiadiazole
CID 163351978
2-(azetidin-1-yl)-6-methylpyridine
CID 54182749
2-(4-methyl-2-pyridinyl)-6-pyridin-2-ylpyridine
CID 66821845
N-(2,6-dimethylphenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112898838
pyridin-2-yl-[1-(4-pyridin-2-ylpyrimidin-2-yl)piperidin-4-yl]methanol
CID 72918650
[1-(4-pyridin-2-ylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 103278821
ethane;3-(6-methyl-2-pyridinyl)-6-pyridin-2-ylpyridazine
CID 143616936
1-[4-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-2-yl]azepane
CID 112898909
2-[4-(6-fluoro-2-pyridinyl)piperazin-1-yl]pyrimidine
CID 61229554

Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine?
The IUPAC name of 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine (CID 72890172) is 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine.
What is the SMILES notation for 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine?
The canonical SMILES for 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine is Cc1cccc(N2CCN(c3nccc(-c4ccccn4)n3)CC2)n1.
What is the InChIKey of 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine?
The InChIKey is CWPNTRCAERUQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6/c1-15-5-4-7-18(22-15)24-11-13-25(14-12-24)19-21-10-8-17(23-19)16-6-2-3-9-20-16/h2-10H,11-14H2,1H3.
What are the key properties of 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine?
2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine has a molecular weight of 332.41 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-methyl-2-pyridinyl)piperazin-1-yl]-4-pyridin-2-ylpyrimidine is sourced from PubChem (CID 72890172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).