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

C10H16N2OS — CID 130898884

IUPAC2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol
SMILESCc1cc(C2(O)CCCNC2C)sn1
InChIInChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(13)4-3-5-11-8(10)2/h6,8,11,13H,3-5H2,1-2H3
InChIKeyFSNNEYKNQSKHHY-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.41
Rot. Bonds1

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

2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol (PubChem CID 130898884) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol.

Molecular Properties

Compound Name2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol
PubChem CID130898884
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol
SMILESCc1cc(C2(O)CCCNC2C)sn1
InChIInChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(13)4-3-5-11-8(10)2/h6,8,11,13H,3-5H2,1-2H3
InChIKeyFSNNEYKNQSKHHY-UHFFFAOYSA-N
XLogP1.41
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol?
The IUPAC name of 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol (CID 130898884) is 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol.
What is the SMILES notation for 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol?
The canonical SMILES for 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol is Cc1cc(C2(O)CCCNC2C)sn1.
What is the InChIKey of 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol?
The InChIKey is FSNNEYKNQSKHHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-7-6-9(14-12-7)10(13)4-3-5-11-8(10)2/h6,8,11,13H,3-5H2,1-2H3.
What are the key properties of 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol?
2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol has a molecular weight of 212.32 g/mol, XLogP of 1.41, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(3-methyl-1,2-thiazol-5-yl)piperidin-3-ol is sourced from PubChem (CID 130898884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).