2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol

C10H16N2OS — CID 131019864

IUPAC2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol
SMILESCC1C(O)CCCN1Cc1cncs1
InChIInChI=1S/C10H16N2OS/c1-8-10(13)3-2-4-12(8)6-9-5-11-7-14-9/h5,7-8,10,13H,2-4,6H2,1H3
InChIKeyLNZCZQDIAUJCCX-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.49
Rot. Bonds2

About 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol

2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol (PubChem CID 131019864) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol.

Molecular Properties

Compound Name2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol
PubChem CID131019864
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol
SMILESCC1C(O)CCCN1Cc1cncs1
InChIInChI=1S/C10H16N2OS/c1-8-10(13)3-2-4-12(8)6-9-5-11-7-14-9/h5,7-8,10,13H,2-4,6H2,1H3
InChIKeyLNZCZQDIAUJCCX-UHFFFAOYSA-N
XLogP1.49
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-hydroxy-1-(1,3-thiazol-5-ylmethyl)pyrrolidine-2-carboximidamide
CID 103953989
5-[[(2R)-2-(fluoromethyl)pyrrolidin-1-yl]methyl]-1,3-thiazole
CID 129487841
2-[1-(1,3-thiazol-5-ylmethyl)pyrrolidin-2-yl]acetic acid
CID 112641386
[3-methyl-1-(1,3-thiazol-5-ylmethyl)pyrrolidin-2-yl]methanol
CID 102788244
1-(1,3-thiazol-5-ylmethyl)azepan-4-ol
CID 126987254
(3R,5S)-5-methyl-1-(1,3-thiazol-5-ylmethyl)pyrrolidin-3-ol
CID 171774639
5-[[2-(bromomethyl)piperidin-1-yl]methyl]-1,3-thiazole
CID 112644416
3-methyl-4-(1,3-thiazol-5-ylmethyl)thiomorpholine
CID 130719595
5-[[(2S)-2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]methyl]-1,3-thiazole
CID 125011600
5-(1,4-diazabicyclo[3.2.2]nonan-4-ylmethyl)-1,3-thiazole
CID 68865181
(2S,3R)-1-[(3-fluoro-4-pyridinyl)methyl]-2-methylpiperidin-3-ol
CID 129349343
N-[4-[1-(1,3-thiazol-5-ylmethyl)pyrrolidin-2-yl]-1,3-thiazol-2-yl]acetamide
CID 155986787

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol?
The IUPAC name of 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol (CID 131019864) is 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol.
What is the SMILES notation for 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol?
The canonical SMILES for 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol is CC1C(O)CCCN1Cc1cncs1.
What is the InChIKey of 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol?
The InChIKey is LNZCZQDIAUJCCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-8-10(13)3-2-4-12(8)6-9-5-11-7-14-9/h5,7-8,10,13H,2-4,6H2,1H3.
What are the key properties of 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol?
2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol has a molecular weight of 212.32 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(1,3-thiazol-5-ylmethyl)piperidin-3-ol is sourced from PubChem (CID 131019864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).