2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide

C15H18N4O2S — CID 56760249

IUPAC2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide
SMILESCc1ccc(C2(O)CCN(c3nc(C(N)=O)cs3)CC2)nc1
InChIInChI=1S/C15H18N4O2S/c1-10-2-3-12(17-8-10)15(21)4-6-19(7-5-15)14-18-11(9-22-14)13(16)20/h2-3,8-9,21H,4-7H2,1H3,(H2,16,20)
InChIKeyKCNDPXPTFNDLCX-UHFFFAOYSA-N
MW318.40 g/mol
LogP1.43
Rot. Bonds3

About 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide

2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide (PubChem CID 56760249) has the molecular formula C15H18N4O2S and a molecular weight of 318.40 g/mol. Its IUPAC name is 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide
PubChem CID56760249
Molecular FormulaC15H18N4O2S
Molecular Weight318.40 g/mol
Exact Mass318.12
IUPAC Name2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide
SMILESCc1ccc(C2(O)CCN(c3nc(C(N)=O)cs3)CC2)nc1
InChIInChI=1S/C15H18N4O2S/c1-10-2-3-12(17-8-10)15(21)4-6-19(7-5-15)14-18-11(9-22-14)13(16)20/h2-3,8-9,21H,4-7H2,1H3,(H2,16,20)
InChIKeyKCNDPXPTFNDLCX-UHFFFAOYSA-N
XLogP1.43
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-(5-Methylpyridin-2-yl)-1-(1,3-thiazol-2-yl)piperidin-4-ol
CID 56760405
N-[6-(4-hydroxy-4-phenylpiperidin-1-yl)pyridin-3-yl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxamide
CID 68245791
N-[1-[6-[1-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]pyridin-2-yl]-2-oxopyridin-4-yl]-1,3-thiazole-4-carboxamide
CID 74223910
N-[1-[6-[1-hydroxy-1-[4-(trifluoromethyl)phenyl]ethyl]pyridin-2-yl]-2-oxopyridin-4-yl]-1,3-thiazole-4-carboxamide
CID 90149400
N-[1-[6-[1-[4-(1,1-difluoropropyl)phenyl]-1-hydroxyethyl]-2-pyridinyl]-2-oxo-4-pyridinyl]-1,3-thiazole-4-carboxamide
CID 123742977
N-[5-[2-[1-hydroxy-1-[3-(trifluoromethyl)phenyl]ethyl]-3H-pyrrol-5-yl]-2-pyridinyl]-1,3-thiazole-4-carboxamide
CID 161694435
2-(4-Fluoro-4-pyridin-3-ylpiperidin-1-yl)-5-methyl-1,3-thiazole-4-carboxylic acid
CID 145878759
2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
CID 16668609
Ethyl 2-[[2-(4-hydroxy-4-pyridin-2-ylpiperidin-1-yl)acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate
CID 16674964
1-(Imidazo[2,1-b][1,3]thiazol-6-ylcarbonyl)-4-(5-methylpyridin-2-yl)piperidin-4-ol
CID 56739466
1-({2-[(Dimethylamino)methyl]-1,3-thiazol-4-yl}carbonyl)-4-(5-methylpyridin-2-yl)piperidin-4-ol
CID 56758925
1-{[2-(Ethylamino)-4-methyl-1,3-thiazol-5-yl]carbonyl}-4-(5-methylpyridin-2-yl)piperidin-4-ol
CID 56759508

Frequently Asked Questions

What is the IUPAC name of 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide (CID 56760249) is 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide is Cc1ccc(C2(O)CCN(c3nc(C(N)=O)cs3)CC2)nc1.
What is the InChIKey of 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide?
The InChIKey is KCNDPXPTFNDLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2S/c1-10-2-3-12(17-8-10)15(21)4-6-19(7-5-15)14-18-11(9-22-14)13(16)20/h2-3,8-9,21H,4-7H2,1H3,(H2,16,20).
What are the key properties of 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide?
2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide has a molecular weight of 318.40 g/mol, XLogP of 1.43, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-hydroxy-4-(5-methyl-2-pyridinyl)piperidin-1-yl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 56760249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).