4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine

C9H7ClN4 — CID 43807323

IUPAC4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine
SMILESCc1cc(Cl)nc(-c2cnccn2)n1
InChIInChI=1S/C9H7ClN4/c1-6-4-8(10)14-9(13-6)7-5-11-2-3-12-7/h2-5H,1H3
InChIKeyGITUVGGZBAXOTH-UHFFFAOYSA-N
MW206.64 g/mol
LogP1.90
Rot. Bonds1

About 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine

4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine (PubChem CID 43807323) has the molecular formula C9H7ClN4 and a molecular weight of 206.64 g/mol. Its IUPAC name is 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine.

Molecular Properties

Compound Name4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine
PubChem CID43807323
Molecular FormulaC9H7ClN4
Molecular Weight206.64 g/mol
Exact Mass206.04
IUPAC Name4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine
SMILESCc1cc(Cl)nc(-c2cnccn2)n1
InChIInChI=1S/C9H7ClN4/c1-6-4-8(10)14-9(13-6)7-5-11-2-3-12-7/h2-5H,1H3
InChIKeyGITUVGGZBAXOTH-UHFFFAOYSA-N
XLogP1.90
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.64
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-methyl-2-pyrazin-2-ylpyrimidin-4-amine
CID 62193018
4-(3,5-dimethylpyrazol-1-yl)-6-methyl-2-pyrazin-2-ylpyrimidine
CID 169409428
2-methyl-N-[(6-methyl-2-pyrazin-2-ylpyrimidin-4-yl)methyl]propan-1-amine
CID 55114573
4-chloro-2-(2,6-dimethyl-4-pyridinyl)-6-methylpyrimidine
CID 107502259
2-methyl-6-pyrazin-2-ylpyridine-4-carboxylic acid
CID 138718150
2-(3,4,5-trimethylphenyl)pyrazine
CID 126550614
5-bromo-6-methyl-2-pyrazin-2-ylpyrimidin-4-amine
CID 66305058
4-chloro-2-(5-fluoro-3-pyridinyl)-6-methylpyrimidine
CID 142460364
4-chloro-2-(4-fluorophenyl)-6-methylpyrimidine
CID 23362081
4-chloro-5-methoxy-2-pyrazin-2-ylpyrimidine
CID 86668897
4-chloro-2-pyrazin-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 61382030
4-chloro-5-iodo-2-pyrazin-2-ylpyrimidine
CID 66292658

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine?
The IUPAC name of 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine (CID 43807323) is 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine.
What is the SMILES notation for 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine?
The canonical SMILES for 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine is Cc1cc(Cl)nc(-c2cnccn2)n1.
What is the InChIKey of 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine?
The InChIKey is GITUVGGZBAXOTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN4/c1-6-4-8(10)14-9(13-6)7-5-11-2-3-12-7/h2-5H,1H3.
What are the key properties of 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine?
4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine has a molecular weight of 206.64 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-methyl-2-pyrazin-2-ylpyrimidine is sourced from PubChem (CID 43807323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).