1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide

C9H13ClN4OS — CID 103197464

IUPAC1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2nsnc2Cl)C1
InChIInChI=1S/C9H13ClN4OS/c1-11-9(15)6-3-2-4-14(5-6)8-7(10)12-16-13-8/h6H,2-5H2,1H3,(H,11,15)
InChIKeyCUWLJJQCRKEOPU-UHFFFAOYSA-N
MW260.75 g/mol
LogP1.15
Rot. Bonds2

About 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide

1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide (PubChem CID 103197464) has the molecular formula C9H13ClN4OS and a molecular weight of 260.75 g/mol. Its IUPAC name is 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide
PubChem CID103197464
Molecular FormulaC9H13ClN4OS
Molecular Weight260.75 g/mol
Exact Mass260.05
IUPAC Name1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide
SMILESCNC(=O)C1CCCN(c2nsnc2Cl)C1
InChIInChI=1S/C9H13ClN4OS/c1-11-9(15)6-3-2-4-14(5-6)8-7(10)12-16-13-8/h6H,2-5H2,1H3,(H,11,15)
InChIKeyCUWLJJQCRKEOPU-UHFFFAOYSA-N
XLogP1.15
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.75
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide 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

1-(4-amino-1-methylpyrazol-3-yl)-N-methylpiperidine-3-carboxamide
CID 103194366
1-(2-aminophenyl)-N-methylpiperidine-3-carboxamide
CID 103194310
1-(3-amino-4-cyclopropyl-1,2-thiazol-5-yl)-N-methylpiperidine-3-carboxamide
CID 103365979
3-amino-2-[3-(methylcarbamoyl)piperidin-1-yl]pyridine-4-carboxylic acid
CID 103197754
N-methyl-1-[5-(methylaminomethyl)-1,3,4-oxadiazol-2-yl]piperidine-3-carboxamide
CID 106965704
1-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-N-methylpiperidine-3-carboxamide
CID 166605809
1-(3-amino-5-bromo-2-pyridinyl)-N-methylpiperidine-3-carboxamide
CID 103194325
1-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103198504
1-(6-chloro-2-propan-2-ylpyrimidin-4-yl)-N-methylpiperidine-3-carboxamide
CID 103197446
1-[2-chloro-4-[(1S)-1-hydroxyethyl]phenyl]-N-methylpiperidine-3-carboxamide
CID 103196759
1-[5-(ethylaminomethyl)pyrimidin-2-yl]-N-methylpiperidine-3-carboxamide
CID 103197016
5-[3-(methylcarbamoyl)piperidin-1-yl]furan-2-carboxylic acid
CID 103196251

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide (CID 103197464) is 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide is CNC(=O)C1CCCN(c2nsnc2Cl)C1.
What is the InChIKey of 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide?
The InChIKey is CUWLJJQCRKEOPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN4OS/c1-11-9(15)6-3-2-4-14(5-6)8-7(10)12-16-13-8/h6H,2-5H2,1H3,(H,11,15).
What are the key properties of 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide?
1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide has a molecular weight of 260.75 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-1,2,5-thiadiazol-3-yl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 103197464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).