2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide

C11H19N5OS — CID 55046237

IUPAC2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide
SMILESCNc1snnc1CN1CCC(CC(N)=O)CC1
InChIInChI=1S/C11H19N5OS/c1-13-11-9(14-15-18-11)7-16-4-2-8(3-5-16)6-10(12)17/h8,13H,2-7H2,1H3,(H2,12,17)
InChIKeyUZVCUZAEBNNRRO-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.67
Rot. Bonds5

About 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide

2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide (PubChem CID 55046237) has the molecular formula C11H19N5OS and a molecular weight of 269.37 g/mol. Its IUPAC name is 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide
PubChem CID55046237
Molecular FormulaC11H19N5OS
Molecular Weight269.37 g/mol
Exact Mass269.13
IUPAC Name2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide
SMILESCNc1snnc1CN1CCC(CC(N)=O)CC1
InChIInChI=1S/C11H19N5OS/c1-13-11-9(14-15-18-11)7-16-4-2-8(3-5-16)6-10(12)17/h8,13H,2-7H2,1H3,(H2,12,17)
InChIKeyUZVCUZAEBNNRRO-UHFFFAOYSA-N
XLogP0.67
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide (CID 55046237) is 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide is CNc1snnc1CN1CCC(CC(N)=O)CC1.
What is the InChIKey of 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide?
The InChIKey is UZVCUZAEBNNRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5OS/c1-13-11-9(14-15-18-11)7-16-4-2-8(3-5-16)6-10(12)17/h8,13H,2-7H2,1H3,(H2,12,17).
What are the key properties of 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide?
2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide has a molecular weight of 269.37 g/mol, XLogP of 0.67, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[5-(methylamino)thiadiazol-4-yl]methyl]piperidin-4-yl]acetamide is sourced from PubChem (CID 55046237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).