N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide

C12H19N5O2S — CID 154789778

IUPACN,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide
SMILESCN(C)C(=O)N1CCN(C(=O)c2csnn2)C(C)(C)C1
InChIInChI=1S/C12H19N5O2S/c1-12(2)8-16(11(19)15(3)4)5-6-17(12)10(18)9-7-20-14-13-9/h7H,5-6,8H2,1-4H3
InChIKeyMZCQJHFVJLKAGR-UHFFFAOYSA-N
MW297.38 g/mol
LogP0.76
Rot. Bonds1

About N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide

N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide (PubChem CID 154789778) has the molecular formula C12H19N5O2S and a molecular weight of 297.38 g/mol. Its IUPAC name is N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide
PubChem CID154789778
Molecular FormulaC12H19N5O2S
Molecular Weight297.38 g/mol
Exact Mass297.13
IUPAC NameN,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide
SMILESCN(C)C(=O)N1CCN(C(=O)c2csnn2)C(C)(C)C1
InChIInChI=1S/C12H19N5O2S/c1-12(2)8-16(11(19)15(3)4)5-6-17(12)10(18)9-7-20-14-13-9/h7H,5-6,8H2,1-4H3
InChIKeyMZCQJHFVJLKAGR-UHFFFAOYSA-N
XLogP0.76
TPSA69.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-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,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide?
The IUPAC name of N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide (CID 154789778) is N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide.
What is the SMILES notation for N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide?
The canonical SMILES for N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide is CN(C)C(=O)N1CCN(C(=O)c2csnn2)C(C)(C)C1.
What is the InChIKey of N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide?
The InChIKey is MZCQJHFVJLKAGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2S/c1-12(2)8-16(11(19)15(3)4)5-6-17(12)10(18)9-7-20-14-13-9/h7H,5-6,8H2,1-4H3.
What are the key properties of N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide?
N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide has a molecular weight of 297.38 g/mol, XLogP of 0.76, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,3,3-tetramethyl-4-(thiadiazole-4-carbonyl)piperazine-1-carboxamide is sourced from PubChem (CID 154789778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).