6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one

C14H17N3OS — CID 56860296

IUPAC6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one
SMILESO=c1cccc(CN2CCCCC2c2nccs2)[nH]1
InChIInChI=1S/C14H17N3OS/c18-13-6-3-4-11(16-13)10-17-8-2-1-5-12(17)14-15-7-9-19-14/h3-4,6-7,9,12H,1-2,5,8,10H2,(H,16,18)
InChIKeyQUVNYBJRBDJAOZ-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.56
Rot. Bonds3

About 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one

6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one (PubChem CID 56860296) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one
PubChem CID56860296
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one
SMILESO=c1cccc(CN2CCCCC2c2nccs2)[nH]1
InChIInChI=1S/C14H17N3OS/c18-13-6-3-4-11(16-13)10-17-8-2-1-5-12(17)14-15-7-9-19-14/h3-4,6-7,9,12H,1-2,5,8,10H2,(H,16,18)
InChIKeyQUVNYBJRBDJAOZ-UHFFFAOYSA-N
XLogP2.56
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1H-pyridin-2-one
CID 171674206
2-[1-[(5-methylthiophen-2-yl)methyl]piperidin-2-yl]-1,3-thiazole
CID 77087825
2-[(2R)-1-[(3-methylquinoxalin-2-yl)methyl]piperidin-2-yl]-1,3-thiazole
CID 99844268
2-methyl-5-[[(2R)-2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1,3,4-thiadiazole
CID 125136328
5-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-amine
CID 120899637
1-phenyl-3-[(2R)-2-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one
CID 124615998
5-methyl-4-[[(2S)-2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-2-thiophen-2-yl-1,3-oxazole
CID 26333322
1-piperazin-1-yl-3-[2-(1,3-thiazol-2-yl)piperidin-1-yl]propan-1-one
CID 120982588
5-methyl-2-(5-methylthiophen-2-yl)-4-[[(2R)-2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1,3-oxazole
CID 42357603
N-(1-methylpyrazol-3-yl)-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]acetamide
CID 91842264
2-propan-2-yl-5-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1,3,4-oxadiazole
CID 91838515
2-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]acetonitrile
CID 130666209

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one?
The IUPAC name of 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one (CID 56860296) is 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one?
The canonical SMILES for 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one is O=c1cccc(CN2CCCCC2c2nccs2)[nH]1.
What is the InChIKey of 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one?
The InChIKey is QUVNYBJRBDJAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c18-13-6-3-4-11(16-13)10-17-8-2-1-5-12(17)14-15-7-9-19-14/h3-4,6-7,9,12H,1-2,5,8,10H2,(H,16,18).
What are the key properties of 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one?
6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one has a molecular weight of 275.38 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(1,3-thiazol-2-yl)piperidin-1-yl]methyl]-1H-pyridin-2-one is sourced from PubChem (CID 56860296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).