[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol

C12H20N2O2S — CID 63979536

IUPAC[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol
SMILESCOCC1CCN(c2nc(C)c(CO)s2)CC1
InChIInChI=1S/C12H20N2O2S/c1-9-11(7-15)17-12(13-9)14-5-3-10(4-6-14)8-16-2/h10,15H,3-8H2,1-2H3
InChIKeySWJJGCIWJQFKNJ-UHFFFAOYSA-N
MW256.37 g/mol
LogP1.81
Rot. Bonds4

About [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol

[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol (PubChem CID 63979536) has the molecular formula C12H20N2O2S and a molecular weight of 256.37 g/mol. Its IUPAC name is [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol
PubChem CID63979536
Molecular FormulaC12H20N2O2S
Molecular Weight256.37 g/mol
Exact Mass256.12
IUPAC Name[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol
SMILESCOCC1CCN(c2nc(C)c(CO)s2)CC1
InChIInChI=1S/C12H20N2O2S/c1-9-11(7-15)17-12(13-9)14-5-3-10(4-6-14)8-16-2/h10,15H,3-8H2,1-2H3
InChIKeySWJJGCIWJQFKNJ-UHFFFAOYSA-N
XLogP1.81
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.37
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[4-methyl-2-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]-1,3-thiazol-5-yl]methanol
CID 63009952
[2-(4-ethoxypiperidin-1-yl)-4-methyl-1,3-thiazol-5-yl]methanol
CID 55117381
[2-(4-benzylpiperidin-1-yl)-4-methyl-1,3-thiazol-5-yl]methanol
CID 62779816
[4-methyl-2-(1,4-thiazepan-4-yl)-1,3-thiazol-5-yl]methanol
CID 62779519
[4-methyl-2-(1-methyl-2,3,4,4a,5,7,8,8a-octahydro-1,6-naphthyridin-6-yl)-1,3-thiazol-5-yl]methanol
CID 81206184
[4-methyl-2-(3-phenylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanol
CID 62780508
[4-methyl-2-(2-methylpyrrolidin-1-yl)-1,3-thiazol-5-yl]methanol
CID 62780487
N-[[2-[3-(methoxymethyl)pyrrolidin-1-yl]-4-propan-2-yl-1,3-thiazol-5-yl]methyl]ethanamine
CID 79392674
2-[4-(methoxymethyl)piperidin-1-yl]-4-propyl-1,3-thiazole-5-carbaldehyde
CID 63979718
N-[[1-[4-chloro-5-(hydroxymethyl)-1,3-thiazol-2-yl]piperidin-4-yl]methyl]acetamide
CID 102736651
N,N-dimethyl-1-[1-[4-methyl-5-(methylaminomethyl)-1,3-thiazol-2-yl]piperidin-4-yl]methanamine
CID 62767701
[6-[4-(methoxymethyl)piperidin-1-yl]-3-pyridinyl]methanol
CID 63971176

Frequently Asked Questions

What is the IUPAC name of [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol (CID 63979536) is [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol is COCC1CCN(c2nc(C)c(CO)s2)CC1.
What is the InChIKey of [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol?
The InChIKey is SWJJGCIWJQFKNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2S/c1-9-11(7-15)17-12(13-9)14-5-3-10(4-6-14)8-16-2/h10,15H,3-8H2,1-2H3.
What are the key properties of [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol?
[2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol has a molecular weight of 256.37 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[4-(methoxymethyl)piperidin-1-yl]-4-methyl-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63979536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).