2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole

C15H20N4S — CID 133328206

IUPAC2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole
SMILESCc1cc(N2CCCC(c3nc(C)cs3)C2)nc(C)n1
InChIInChI=1S/C15H20N4S/c1-10-7-14(18-12(3)16-10)19-6-4-5-13(8-19)15-17-11(2)9-20-15/h7,9,13H,4-6,8H2,1-3H3
InChIKeyHDUKMIFQJXWPAB-UHFFFAOYSA-N
MW288.42 g/mol
LogP3.24
Rot. Bonds2

About 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole

2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole (PubChem CID 133328206) has the molecular formula C15H20N4S and a molecular weight of 288.42 g/mol. Its IUPAC name is 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole.

Molecular Properties

Compound Name2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole
PubChem CID133328206
Molecular FormulaC15H20N4S
Molecular Weight288.42 g/mol
Exact Mass288.14
IUPAC Name2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole
SMILESCc1cc(N2CCCC(c3nc(C)cs3)C2)nc(C)n1
InChIInChI=1S/C15H20N4S/c1-10-7-14(18-12(3)16-10)19-6-4-5-13(8-19)15-17-11(2)9-20-15/h7,9,13H,4-6,8H2,1-3H3
InChIKeyHDUKMIFQJXWPAB-UHFFFAOYSA-N
XLogP3.24
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2,6-dimethylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 62547071
2,4-dimethyl-6-[3-(1-methylpyrazol-3-yl)piperidin-1-yl]pyrimidine
CID 119103538
4-methyl-2-(1-pyrido[2,3-b]pyrazin-6-ylpiperidin-3-yl)-1,3-thiazole
CID 133301256
1-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]ethanone
CID 63846335
4-[3-(2-chloroethyl)piperidin-1-yl]-2,6-dimethylpyrimidine
CID 55185138
2-[5-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]pyrazol-1-yl]ethanol
CID 71891326
1-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-N-methylethanamine
CID 63852838
[(3R)-3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 95779008
4-[(3S)-3-[5-[(4-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]-2,6-dimethylpyrimidine
CID 125007611
4-[3-[5-[(4-chlorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]-2,6-dimethylpyrimidine
CID 110093323
2-[1-(6-ethyl-2-methylpyrimidin-4-yl)piperidin-3-yl]-4,5,6,7-tetrahydro-1,3-benzothiazole
CID 133472763
2-methoxy-1-[(3R)-3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanone
CID 95051897

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole?
The IUPAC name of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole (CID 133328206) is 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole.
What is the SMILES notation for 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole?
The canonical SMILES for 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole is Cc1cc(N2CCCC(c3nc(C)cs3)C2)nc(C)n1.
What is the InChIKey of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole?
The InChIKey is HDUKMIFQJXWPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4S/c1-10-7-14(18-12(3)16-10)19-6-4-5-13(8-19)15-17-11(2)9-20-15/h7,9,13H,4-6,8H2,1-3H3.
What are the key properties of 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole?
2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole has a molecular weight of 288.42 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,6-dimethylpyrimidin-4-yl)piperidin-3-yl]-4-methyl-1,3-thiazole is sourced from PubChem (CID 133328206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).