N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide

C11H17FN4OS — CID 165431829

IUPACN-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1(F)CCN(c2nc(C)ns2)CC1
InChIInChI=1S/C11H17FN4OS/c1-8-14-10(18-15-8)16-5-3-11(12,4-6-16)7-13-9(2)17/h3-7H2,1-2H3,(H,13,17)
InChIKeyJOZNVSLIGIKHLU-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.29
Rot. Bonds3

About N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide

N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide (PubChem CID 165431829) has the molecular formula C11H17FN4OS and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide
PubChem CID165431829
Molecular FormulaC11H17FN4OS
Molecular Weight272.35 g/mol
Exact Mass272.11
IUPAC NameN-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide
SMILESCC(=O)NCC1(F)CCN(c2nc(C)ns2)CC1
InChIInChI=1S/C11H17FN4OS/c1-8-14-10(18-15-8)16-5-3-11(12,4-6-16)7-13-9(2)17/h3-7H2,1-2H3,(H,13,17)
InChIKeyJOZNVSLIGIKHLU-UHFFFAOYSA-N
XLogP1.29
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(3-ethyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-N-propylacetamide
CID 72115341
4-(aminomethyl)-N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
CID 46984917
3-(aminomethyl)-N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
CID 46986528
N-(3-Methyl-1,2,4-thiadiazol-5-YL)piperidine-4-carboxamide
CID 91636200
N-[(3S)-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]butanamide
CID 96567409
4-fluoro-N-(3-methyl-1,2,4-thiadiazol-5-yl)piperidine-1-carboxamide
CID 46990975
2,2,2-trifluoro-N-[2-methyl-3-[5-(2-methylpropylamino)-1,2,4-thiadiazol-3-yl]propyl]acetamide
CID 174154467
1-Piperidin-1-yl-3-[[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]amino]propan-1-one
CID 107305117
N-methyl-2-[1-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]ethanamine
CID 107305367
N-ethyl-N-(piperidin-4-ylmethyl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107305423
N-(piperidin-4-ylmethyl)-N-propyl-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107305425
N-[[1-[3-(trifluoromethyl)-1,2,4-thiadiazol-5-yl]piperidin-4-yl]methyl]ethanamine
CID 107305439

Frequently Asked Questions

What is the IUPAC name of N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide?
The IUPAC name of N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide (CID 165431829) is N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide.
What is the SMILES notation for N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide?
The canonical SMILES for N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide is CC(=O)NCC1(F)CCN(c2nc(C)ns2)CC1.
What is the InChIKey of N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide?
The InChIKey is JOZNVSLIGIKHLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN4OS/c1-8-14-10(18-15-8)16-5-3-11(12,4-6-16)7-13-9(2)17/h3-7H2,1-2H3,(H,13,17).
What are the key properties of N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide?
N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide has a molecular weight of 272.35 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-fluoro-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]methyl]acetamide is sourced from PubChem (CID 165431829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).