4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine

C15H11ClN4 — CID 86633449

IUPAC4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine
SMILESCc1cccc(-c2nc(Cl)cc(-c3cccnc3)n2)n1
InChIInChI=1S/C15H11ClN4/c1-10-4-2-6-12(18-10)15-19-13(8-14(16)20-15)11-5-3-7-17-9-11/h2-9H,1H3
InChIKeyGPWSVYIEENMSLG-UHFFFAOYSA-N
MW282.73 g/mol
LogP3.56
Rot. Bonds2

About 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine

4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine (PubChem CID 86633449) has the molecular formula C15H11ClN4 and a molecular weight of 282.73 g/mol. Its IUPAC name is 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine.

Molecular Properties

Compound Name4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine
PubChem CID86633449
Molecular FormulaC15H11ClN4
Molecular Weight282.73 g/mol
Exact Mass282.07
IUPAC Name4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine
SMILESCc1cccc(-c2nc(Cl)cc(-c3cccnc3)n2)n1
InChIInChI=1S/C15H11ClN4/c1-10-4-2-6-12(18-10)15-19-13(8-14(16)20-15)11-5-3-7-17-9-11/h2-9H,1H3
InChIKeyGPWSVYIEENMSLG-UHFFFAOYSA-N
XLogP3.56
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.73
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;2-methyl-6-pyridin-3-ylpyridine
CID 144687863
2-methyl-6-pyridin-3-ylpyridine;propane
CID 144615785
4-chloro-6-(1-methylpyrazol-4-yl)-2-(6-methyl-2-pyridinyl)pyrimidine
CID 106715293
3-[2-[[2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidin-4-yl]amino]ethyl]phenol
CID 24863368
4-chloro-6-(2-fluorophenyl)-2-(6-methyl-2-pyridinyl)pyrimidine
CID 14623118
2-(6-methyl-2-pyridinyl)-4-pyridin-3-yl-7H-pyrrolo[2,3-d]pyrimidine
CID 68935386
2,6-dipyridin-3-ylpyridine
CID 13349632
4-chloro-2-pyridin-3-yl-6-[4-(trifluoromethyl)phenyl]pyrimidine
CID 156866103
6-chloro-N,N-diethyl-2-(6-methyl-2-pyridinyl)pyrimidin-4-amine
CID 15766444
4-chloro-6-(5-methyl-3-pyridinyl)-2-phenylpyrimidine
CID 115915028
2-[3,5-bis[6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]phenyl]-6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyridine
CID 58090487
4,6-dimethyl-2-pyridin-3-ylpyrimidine
CID 55218547

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine?
The IUPAC name of 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine (CID 86633449) is 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine.
What is the SMILES notation for 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine?
The canonical SMILES for 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine is Cc1cccc(-c2nc(Cl)cc(-c3cccnc3)n2)n1.
What is the InChIKey of 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine?
The InChIKey is GPWSVYIEENMSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN4/c1-10-4-2-6-12(18-10)15-19-13(8-14(16)20-15)11-5-3-7-17-9-11/h2-9H,1H3.
What are the key properties of 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine?
4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine has a molecular weight of 282.73 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-(6-methyl-2-pyridinyl)-6-pyridin-3-ylpyrimidine is sourced from PubChem (CID 86633449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).