4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine

C13H17N5 — CID 124641631

IUPAC4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine
SMILESCc1cc(-c2ccnn2C)nc([C@H]2CCCN2)n1
InChIInChI=1S/C13H17N5/c1-9-8-11(12-5-7-15-18(12)2)17-13(16-9)10-4-3-6-14-10/h5,7-8,10,14H,3-4,6H2,1-2H3/t10-/m1/s1
InChIKeyHDOXFZPEYYPHMA-SNVBAGLBSA-N
MW243.31 g/mol
LogP1.61
Rot. Bonds2

About 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine

4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine (PubChem CID 124641631) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine.

Molecular Properties

Compound Name4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine
PubChem CID124641631
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine
SMILESCc1cc(-c2ccnn2C)nc([C@H]2CCCN2)n1
InChIInChI=1S/C13H17N5/c1-9-8-11(12-5-7-15-18(12)2)17-13(16-9)10-4-3-6-14-10/h5,7-8,10,14H,3-4,6H2,1-2H3/t10-/m1/s1
InChIKeyHDOXFZPEYYPHMA-SNVBAGLBSA-N
XLogP1.61
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methyl-2-[(2R)-piperidin-2-yl]-6-(2-propylpyrazol-3-yl)pyrimidine
CID 124964353
4-methyl-2-[(2S)-1-methylpiperidin-2-yl]-6-(2-methylpyrazol-3-yl)pyrimidine
CID 124973079
4-cyclohexyl-6-methyl-2-pyrrolidin-2-ylpyrimidine
CID 63319069
4-methyl-6-(2-methylphenyl)-2-pyrrolidin-2-ylpyrimidine
CID 116893348
1-[(3S)-3-[4-methyl-6-(2-methylpyrazol-3-yl)pyrimidin-2-yl]pyrrolidin-1-yl]ethanone
CID 124956672
2,4-dimethyl-6-(2-methylpyrazol-3-yl)pyridine
CID 90367967
5-methyl-2-(6-methyl-2-pyrrolidin-2-ylpyrimidin-4-yl)-1,3-thiazole
CID 110100411
4-methyl-2-[(3R)-piperidin-3-yl]-6-(2-propylpyrazol-3-yl)pyrimidine
CID 124971396
4-methyl-6-[(2S)-pyrrolidin-2-yl]pyrimidin-2-amine
CID 83858445
4-methyl-6-(2-methylpropyl)-2-piperidin-2-ylpyrimidine
CID 116893407
1,5-dimethyl-4-[(2S)-pyrrolidin-2-yl]pyrazole
CID 96736955
1,3-dimethyl-5-[(2R)-pyrrolidin-2-yl]pyrazole
CID 42575745

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine?
The IUPAC name of 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine (CID 124641631) is 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine.
What is the SMILES notation for 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine?
The canonical SMILES for 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine is Cc1cc(-c2ccnn2C)nc([C@H]2CCCN2)n1.
What is the InChIKey of 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine?
The InChIKey is HDOXFZPEYYPHMA-SNVBAGLBSA-N. The full InChI is InChI=1S/C13H17N5/c1-9-8-11(12-5-7-15-18(12)2)17-13(16-9)10-4-3-6-14-10/h5,7-8,10,14H,3-4,6H2,1-2H3/t10-/m1/s1.
What are the key properties of 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine?
4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine has a molecular weight of 243.31 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(2-methylpyrazol-3-yl)-2-[(2R)-pyrrolidin-2-yl]pyrimidine is sourced from PubChem (CID 124641631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).