N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide

C10H18N4O2S2 — CID 61253919

IUPACN-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide
SMILESCc1ncc(CN(C)S(=O)(=O)N2CCNCC2)s1
InChIInChI=1S/C10H18N4O2S2/c1-9-12-7-10(17-9)8-13(2)18(15,16)14-5-3-11-4-6-14/h7,11H,3-6,8H2,1-2H3
InChIKeyWNNYZFHFKYFPIW-UHFFFAOYSA-N
MW290.41 g/mol
LogP0.03
Rot. Bonds4

About N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide

N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide (PubChem CID 61253919) has the molecular formula C10H18N4O2S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide.

Molecular Properties

Compound NameN-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide
PubChem CID61253919
Molecular FormulaC10H18N4O2S2
Molecular Weight290.41 g/mol
Exact Mass290.09
IUPAC NameN-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide
SMILESCc1ncc(CN(C)S(=O)(=O)N2CCNCC2)s1
InChIInChI=1S/C10H18N4O2S2/c1-9-12-7-10(17-9)8-13(2)18(15,16)14-5-3-11-4-6-14/h7,11H,3-6,8H2,1-2H3
InChIKeyWNNYZFHFKYFPIW-UHFFFAOYSA-N
XLogP0.03
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide 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-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide?
The IUPAC name of N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide (CID 61253919) is N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide.
What is the SMILES notation for N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide?
The canonical SMILES for N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide is Cc1ncc(CN(C)S(=O)(=O)N2CCNCC2)s1.
What is the InChIKey of N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide?
The InChIKey is WNNYZFHFKYFPIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O2S2/c1-9-12-7-10(17-9)8-13(2)18(15,16)14-5-3-11-4-6-14/h7,11H,3-6,8H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide?
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide has a molecular weight of 290.41 g/mol, XLogP of 0.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperazine-1-sulfonamide is sourced from PubChem (CID 61253919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).