4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine

C11H9Cl2N3 — CID 20648934

IUPAC4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine
SMILESCc1ccc(-c2nc(C)c(Cl)c(Cl)n2)nc1
InChIInChI=1S/C11H9Cl2N3/c1-6-3-4-8(14-5-6)11-15-7(2)9(12)10(13)16-11/h3-5H,1-2H3
InChIKeyMRXYITPUBZKLOI-UHFFFAOYSA-N
MW254.12 g/mol
LogP3.46
Rot. Bonds1

About 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine

4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine (PubChem CID 20648934) has the molecular formula C11H9Cl2N3 and a molecular weight of 254.12 g/mol. Its IUPAC name is 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine.

Molecular Properties

Compound Name4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine
PubChem CID20648934
Molecular FormulaC11H9Cl2N3
Molecular Weight254.12 g/mol
Exact Mass253.02
IUPAC Name4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine
SMILESCc1ccc(-c2nc(C)c(Cl)c(Cl)n2)nc1
InChIInChI=1S/C11H9Cl2N3/c1-6-3-4-8(14-5-6)11-15-7(2)9(12)10(13)16-11/h3-5H,1-2H3
InChIKeyMRXYITPUBZKLOI-UHFFFAOYSA-N
XLogP3.46
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.12
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-6-ethyl-5-iodo-2-(5-methyl-2-pyridinyl)pyrimidine
CID 81312976
5-bromo-4-chloro-2-(5-methyl-2-pyridinyl)-6-phenylpyrimidine
CID 81308439
5-chloro-N-(3-methoxyphenyl)-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidin-4-amine
CID 21304985
2-(5-methyl-2-pyridinyl)-4,6-dipyridin-2-yl-1,3,5-triazine
CID 58261693
5-methyl-2-[3-methyl-5-(5-methyl-2-pyridinyl)phenyl]pyridine
CID 58637248
dichloroosmium;bis(5-methyl-2-(5-methyl-2-pyridinyl)pyridine)
CID 59404466
4-chloro-6-(2-methylpropyl)-2-(5-methyl-2-pyridinyl)pyrimidine
CID 81313415
N,5-diethyl-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidin-4-amine
CID 81311692
2,4,6-tris[6-(5-methyl-2-pyridinyl)-3-pyridinyl]-1,3,5-triazine
CID 58261715
5-bromo-6-methyl-2-(5-methyl-2-pyridinyl)-N-propylpyrimidin-4-amine
CID 81311702
5-methyl-2-[4-(trideuteriomethyl)phenyl]pyridine
CID 157240275
2-(3-fluoro-5-methylphenyl)-5-methylpyridine
CID 147408011

Frequently Asked Questions

What is the IUPAC name of 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine?
The IUPAC name of 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine (CID 20648934) is 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine.
What is the SMILES notation for 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine?
The canonical SMILES for 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine is Cc1ccc(-c2nc(C)c(Cl)c(Cl)n2)nc1.
What is the InChIKey of 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine?
The InChIKey is MRXYITPUBZKLOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Cl2N3/c1-6-3-4-8(14-5-6)11-15-7(2)9(12)10(13)16-11/h3-5H,1-2H3.
What are the key properties of 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine?
4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine has a molecular weight of 254.12 g/mol, XLogP of 3.46, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dichloro-6-methyl-2-(5-methyl-2-pyridinyl)pyrimidine is sourced from PubChem (CID 20648934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).