N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide

C11H19N5OS — CID 80606401

IUPACN-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1nnc(NC)s1
InChIInChI=1S/C11H19N5OS/c1-12-10(17)8-5-3-4-6-16(8)7-9-14-15-11(13-2)18-9/h8H,3-7H2,1-2H3,(H,12,17)(H,13,15)
InChIKeyREFKUSBDVBOQKV-UHFFFAOYSA-N
MW269.37 g/mol
LogP0.68
Rot. Bonds4

About N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide

N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide (PubChem CID 80606401) has the molecular formula C11H19N5OS and a molecular weight of 269.37 g/mol. Its IUPAC name is N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide
PubChem CID80606401
Molecular FormulaC11H19N5OS
Molecular Weight269.37 g/mol
Exact Mass269.13
IUPAC NameN-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1Cc1nnc(NC)s1
InChIInChI=1S/C11H19N5OS/c1-12-10(17)8-5-3-4-6-16(8)7-9-14-15-11(13-2)18-9/h8H,3-7H2,1-2H3,(H,12,17)(H,13,15)
InChIKeyREFKUSBDVBOQKV-UHFFFAOYSA-N
XLogP0.68
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide 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 N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide?
The IUPAC name of N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide (CID 80606401) is N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide is CNC(=O)C1CCCCN1Cc1nnc(NC)s1.
What is the InChIKey of N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide?
The InChIKey is REFKUSBDVBOQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5OS/c1-12-10(17)8-5-3-4-6-16(8)7-9-14-15-11(13-2)18-9/h8H,3-7H2,1-2H3,(H,12,17)(H,13,15).
What are the key properties of N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide?
N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide has a molecular weight of 269.37 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[[5-(methylamino)-1,3,4-thiadiazol-2-yl]methyl]piperidine-2-carboxamide is sourced from PubChem (CID 80606401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).