1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol

C15H18N2OS — CID 127030164

IUPAC1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol
SMILESOC1(c2nccs2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C15H18N2OS/c18-15(14-16-8-11-19-14)6-9-17(10-7-15)12-13-4-2-1-3-5-13/h1-5,8,11,18H,6-7,9-10,12H2
InChIKeyCSLHZUDHORPRKN-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.63
Rot. Bonds3

About 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol

1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol (PubChem CID 127030164) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol.

Molecular Properties

Compound Name1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol
PubChem CID127030164
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol
SMILESOC1(c2nccs2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C15H18N2OS/c18-15(14-16-8-11-19-14)6-9-17(10-7-15)12-13-4-2-1-3-5-13/h1-5,8,11,18H,6-7,9-10,12H2
InChIKeyCSLHZUDHORPRKN-UHFFFAOYSA-N
XLogP2.63
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol?
The IUPAC name of 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol (CID 127030164) is 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol.
What is the SMILES notation for 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol?
The canonical SMILES for 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol is OC1(c2nccs2)CCN(Cc2ccccc2)CC1.
What is the InChIKey of 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol?
The InChIKey is CSLHZUDHORPRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2OS/c18-15(14-16-8-11-19-14)6-9-17(10-7-15)12-13-4-2-1-3-5-13/h1-5,8,11,18H,6-7,9-10,12H2.
What are the key properties of 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol?
1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol has a molecular weight of 274.39 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-(1,3-thiazol-2-yl)piperidin-4-ol is sourced from PubChem (CID 127030164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).