5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole

C14H18N4S — CID 110100448

IUPAC5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole
SMILESCc1nc(-c2ncc(C)s2)cc(C2CCCN2C)n1
InChIInChI=1S/C14H18N4S/c1-9-8-15-14(19-9)12-7-11(16-10(2)17-12)13-5-4-6-18(13)3/h7-8,13H,4-6H2,1-3H3
InChIKeyXZPMTFRREWBZQC-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.98
Rot. Bonds2

About 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole

5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole (PubChem CID 110100448) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole.

Molecular Properties

Compound Name5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole
PubChem CID110100448
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole
SMILESCc1nc(-c2ncc(C)s2)cc(C2CCCN2C)n1
InChIInChI=1S/C14H18N4S/c1-9-8-15-14(19-9)12-7-11(16-10(2)17-12)13-5-4-6-18(13)3/h7-8,13H,4-6H2,1-3H3
InChIKeyXZPMTFRREWBZQC-UHFFFAOYSA-N
XLogP2.98
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-6-(1-methylpyrrolidin-2-yl)-N-pyrimidin-2-ylpyrimidin-4-amine
CID 110269635
2-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-6-(2-propan-2-ylpyrazol-3-yl)pyrimidine
CID 125012000
N-[2-methyl-6-[(2R)-1-methylpyrrolidin-2-yl]pyrimidin-4-yl]-1,3,4-thiadiazol-2-amine
CID 95820356
2-methyl-4-[(2R)-1-methylpiperidin-2-yl]-6-(2-propan-2-ylpyrazol-3-yl)pyrimidine
CID 124994880
4-(1-methylpyrrolidin-2-yl)-1,3-thiazole
CID 143153913
4-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-2-amine
CID 59551929
5-methyl-N-[2-methyl-6-[(2S)-1-piperidin-1-ylsulfonylpyrrolidin-2-yl]pyrimidin-4-yl]-1,3-thiazol-2-amine
CID 95820160
2-methyl-4-(5-methyl-1H-imidazol-2-yl)-6-[(2R)-1-pyrimidin-2-ylpyrrolidin-2-yl]pyrimidine
CID 125012503
5-methyl-2-[(2R)-1-methylpyrrolidin-2-yl]pyridine
CID 97304838
2-methyl-4-(5-methyl-1H-imidazol-2-yl)-6-(1-methylsulfonylpiperidin-2-yl)pyrimidine
CID 110099539
6-(1-methylpyrrolidin-2-yl)pyridine-3-carbonitrile
CID 115017325
4-methyl-2-[2-methyl-6-(1-methylsulfonylpiperidin-2-yl)pyrimidin-4-yl]-1,3-thiazole
CID 110100445

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole?
The IUPAC name of 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole (CID 110100448) is 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole.
What is the SMILES notation for 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole?
The canonical SMILES for 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole is Cc1nc(-c2ncc(C)s2)cc(C2CCCN2C)n1.
What is the InChIKey of 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole?
The InChIKey is XZPMTFRREWBZQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-9-8-15-14(19-9)12-7-11(16-10(2)17-12)13-5-4-6-18(13)3/h7-8,13H,4-6H2,1-3H3.
What are the key properties of 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole?
5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole has a molecular weight of 274.39 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[2-methyl-6-(1-methylpyrrolidin-2-yl)pyrimidin-4-yl]-1,3-thiazole is sourced from PubChem (CID 110100448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).