[2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol

C11H18N2OS — CID 62752644

IUPAC[2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol
SMILESCC1CCCN(c2ncc(CO)s2)C1C
InChIInChI=1S/C11H18N2OS/c1-8-4-3-5-13(9(8)2)11-12-6-10(7-14)15-11/h6,8-9,14H,3-5,7H2,1-2H3
InChIKeyQYHAVHHDHOUOKQ-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.26
Rot. Bonds2

About [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol

[2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol (PubChem CID 62752644) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol
PubChem CID62752644
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name[2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol
SMILESCC1CCCN(c2ncc(CO)s2)C1C
InChIInChI=1S/C11H18N2OS/c1-8-4-3-5-13(9(8)2)11-12-6-10(7-14)15-11/h6,8-9,14H,3-5,7H2,1-2H3
InChIKeyQYHAVHHDHOUOKQ-UHFFFAOYSA-N
XLogP2.26
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol (CID 62752644) is [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol is CC1CCCN(c2ncc(CO)s2)C1C.
What is the InChIKey of [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
The InChIKey is QYHAVHHDHOUOKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-8-4-3-5-13(9(8)2)11-12-6-10(7-14)15-11/h6,8-9,14H,3-5,7H2,1-2H3.
What are the key properties of [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol?
[2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol has a molecular weight of 226.34 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-dimethylpiperidin-1-yl)-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 62752644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).