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

C15H20N4OS — CID 2745354

IUPAC4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole
SMILESCOCc1cc(N2CCCCC2)nc(-c2csc(C)n2)n1
InChIInChI=1S/C15H20N4OS/c1-11-16-13(10-21-11)15-17-12(9-20-2)8-14(18-15)19-6-4-3-5-7-19/h8,10H,3-7,9H2,1-2H3
InChIKeyWVIGLKVIDHIXNR-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.05
Rot. Bonds4

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

4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole (PubChem CID 2745354) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole.

Molecular Properties

Compound Name4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole
PubChem CID2745354
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC Name4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole
SMILESCOCc1cc(N2CCCCC2)nc(-c2csc(C)n2)n1
InChIInChI=1S/C15H20N4OS/c1-11-16-13(10-21-11)15-17-12(9-20-2)8-14(18-15)19-6-4-3-5-7-19/h8,10H,3-7,9H2,1-2H3
InChIKeyWVIGLKVIDHIXNR-UHFFFAOYSA-N
XLogP3.05
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]-1,4-diazepane
CID 71564074
1-[6-(methoxymethyl)-2-phenylpyrimidin-4-yl]piperidine-4-carboxylic acid
CID 71564077
2-[1-[2-tert-butyl-6-(methoxymethyl)pyrimidin-4-yl]piperidin-4-yl]-4-methyl-1,3-thiazole
CID 133400871
4-(4-methoxy-6-methylpyrimidin-2-yl)-2-methyl-1,3-thiazole
CID 2745334
4-chloro-6-(methoxymethyl)-2-piperidin-1-ylpyrimidine
CID 62319950
1-[6-(methoxymethyl)-2-methylpyrimidin-4-yl]piperidine-3-carboxylic acid
CID 110277709
4-ethyl-2-methoxy-6-pyrrolidin-1-ylpyrimidine
CID 178092241
2-(azepan-1-yl)-N-ethyl-6-(methoxymethyl)pyrimidin-4-amine
CID 62318582
2-[4-[6-(methoxymethyl)-2-pyridin-4-ylpyrimidin-4-yl]piperazin-1-yl]acetic acid
CID 56768552
4-[1-[6-(methoxymethyl)pyrimidin-4-yl]-4-phenylpiperidin-4-yl]-2-methyl-1,3-thiazole
CID 165427300
4-piperidin-1-yl-6-propylpyrimidin-2-amine
CID 172740401
1-[6-(methoxymethyl)-2-pyridin-4-ylpyrimidin-4-yl]piperidine-2-carboxylic acid
CID 56767437

Frequently Asked Questions

What is the IUPAC name of 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole?
The IUPAC name of 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole (CID 2745354) is 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole.
What is the SMILES notation for 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole?
The canonical SMILES for 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole is COCc1cc(N2CCCCC2)nc(-c2csc(C)n2)n1.
What is the InChIKey of 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole?
The InChIKey is WVIGLKVIDHIXNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-11-16-13(10-21-11)15-17-12(9-20-2)8-14(18-15)19-6-4-3-5-7-19/h8,10H,3-7,9H2,1-2H3.
What are the key properties of 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole?
4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole has a molecular weight of 304.42 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(methoxymethyl)-6-piperidin-1-ylpyrimidin-2-yl]-2-methyl-1,3-thiazole is sourced from PubChem (CID 2745354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).