N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide

C16H19FN4O2S — CID 162769248

IUPACN-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(CN2CCCC(Oc3ccc(F)cn3)C2)s1
InChIInChI=1S/C16H19FN4O2S/c1-11(22)20-16-19-8-14(24-16)10-21-6-2-3-13(9-21)23-15-5-4-12(17)7-18-15/h4-5,7-8,13H,2-3,6,9-10H2,1H3,(H,19,20,22)
InChIKeyVDCHSAPAFDLPLI-UHFFFAOYSA-N
MW350.42 g/mol
LogP2.68
Rot. Bonds5

About N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide

N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 162769248) has the molecular formula C16H19FN4O2S and a molecular weight of 350.42 g/mol. Its IUPAC name is N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
PubChem CID162769248
Molecular FormulaC16H19FN4O2S
Molecular Weight350.42 g/mol
Exact Mass350.12
IUPAC NameN-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(CN2CCCC(Oc3ccc(F)cn3)C2)s1
InChIInChI=1S/C16H19FN4O2S/c1-11(22)20-16-19-8-14(24-16)10-21-6-2-3-13(9-21)23-15-5-4-12(17)7-18-15/h4-5,7-8,13H,2-3,6,9-10H2,1H3,(H,19,20,22)
InChIKeyVDCHSAPAFDLPLI-UHFFFAOYSA-N
XLogP2.68
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide with MolForge

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Related Compounds

N-[5-[[(3S)-3-[(2,6-dimethyl-4-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide;sulfane
CID 160933841
N-[5-[[3-[(1R)-1-(5-fluoropyrimidin-2-yl)ethyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 175123965
N-[5-[[(3S)-3-[1-(5-fluoropyrimidin-2-yl)ethyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 175124459
cesium;carbanide;N-[5-[[3-[(5-fluoropyrimidin-2-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 153344093
N-[5-[[(2S)-2-[(5-fluoropyrimidin-2-yl)methyl]-1,4-oxazepan-4-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 146629065
N-[5-[[(3S)-3-[(5-fluoro-3-pyridinyl)methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 139491347
N-[5-[[(3R)-3-[[5-(trifluoromethyl)pyrimidin-2-yl]methyl]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 139500930
1-[(2-acetamido-1,3-thiazol-5-yl)methyl]-N-cyclohexylpiperidine-3-carboxamide
CID 163368407
N-[5-[[(3S)-3-(1H-pyrrolo[3,2-b]pyridin-6-yl)piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 142415432
N-[5-[[(3R)-3-[(5-fluoro-4,6-dimethylpyrimidin-2-yl)methyl]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 158570276
2-[4-[(2-acetamido-1,3-thiazol-5-yl)methyl]piperazin-1-yl]-N-(4-fluorophenyl)acetamide
CID 163368401
N-[5-[[3-[(2,6-dimethyl-4-pyridinyl)methoxy]pyrrolidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
CID 135135119

Frequently Asked Questions

What is the IUPAC name of N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide (CID 162769248) is N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc(CN2CCCC(Oc3ccc(F)cn3)C2)s1.
What is the InChIKey of N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is VDCHSAPAFDLPLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4O2S/c1-11(22)20-16-19-8-14(24-16)10-21-6-2-3-13(9-21)23-15-5-4-12(17)7-18-15/h4-5,7-8,13H,2-3,6,9-10H2,1H3,(H,19,20,22).
What are the key properties of N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 350.42 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[3-[(5-fluoro-2-pyridinyl)oxy]piperidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 162769248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).