4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol

C14H17N3OS — CID 56760405

IUPAC4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol
SMILESCc1ccc(C2(O)CCN(c3nccs3)CC2)nc1
InChIInChI=1S/C14H17N3OS/c1-11-2-3-12(16-10-11)14(18)4-7-17(8-5-14)13-15-6-9-19-13/h2-3,6,9-10,18H,4-5,7-8H2,1H3
InChIKeyPIHFGMMRTFFMII-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.33
Rot. Bonds2

About 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol

4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol (PubChem CID 56760405) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol.

Molecular Properties

Compound Name4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol
PubChem CID56760405
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol
SMILESCc1ccc(C2(O)CCN(c3nccs3)CC2)nc1
InChIInChI=1S/C14H17N3OS/c1-11-2-3-12(16-10-11)14(18)4-7-17(8-5-14)13-15-6-9-19-13/h2-3,6,9-10,18H,4-5,7-8H2,1H3
InChIKeyPIHFGMMRTFFMII-UHFFFAOYSA-N
XLogP2.33
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol?
The IUPAC name of 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol (CID 56760405) is 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol.
What is the SMILES notation for 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol?
The canonical SMILES for 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol is Cc1ccc(C2(O)CCN(c3nccs3)CC2)nc1.
What is the InChIKey of 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol?
The InChIKey is PIHFGMMRTFFMII-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-11-2-3-12(16-10-11)14(18)4-7-17(8-5-14)13-15-6-9-19-13/h2-3,6,9-10,18H,4-5,7-8H2,1H3.
What are the key properties of 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol?
4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol has a molecular weight of 275.38 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-methyl-2-pyridinyl)-1-(1,3-thiazol-2-yl)piperidin-4-ol is sourced from PubChem (CID 56760405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).