N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide

C6H8N4OS2 — CID 65216482

IUPACN-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide
SMILESCN(CC(N)=S)C(=O)c1csnn1
InChIInChI=1S/C6H8N4OS2/c1-10(2-5(7)12)6(11)4-3-13-9-8-4/h3H,2H2,1H3,(H2,7,12)
InChIKeyLRMGDRSJAGAGTP-UHFFFAOYSA-N
MW216.29 g/mol
LogP-0.10
Rot. Bonds3

About N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide

N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide (PubChem CID 65216482) has the molecular formula C6H8N4OS2 and a molecular weight of 216.29 g/mol. Its IUPAC name is N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide
PubChem CID65216482
Molecular FormulaC6H8N4OS2
Molecular Weight216.29 g/mol
Exact Mass216.01
IUPAC NameN-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide
SMILESCN(CC(N)=S)C(=O)c1csnn1
InChIInChI=1S/C6H8N4OS2/c1-10(2-5(7)12)6(11)4-3-13-9-8-4/h3H,2H2,1H3,(H2,7,12)
InChIKeyLRMGDRSJAGAGTP-UHFFFAOYSA-N
XLogP-0.10
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

Analyze N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-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

N-(3-amino-3-sulfanylidenepropyl)-N-ethylthiadiazole-4-carboxamide
CID 65216427
N,N-diethylthiadiazole-4-carboxamide
CID 60757863
N-(2-amino-1-cyclopropylethyl)-N-methylthiadiazole-4-carboxamide
CID 116652070
N-(2-amino-2-sulfanylideneethyl)-3-chloro-N-methylthiophene-2-carboxamide
CID 80644976
N,N-bis(2-hydroxyethyl)thiadiazole-4-carboxamide
CID 65216327
3-[4-[[methyl(thiadiazole-4-carbonyl)amino]methyl]phenyl]prop-2-enoic acid
CID 77060560
N-(2-amino-2-sulfanylideneethyl)-N-methyl-5-(trifluoromethyl)pyridine-2-carboxamide
CID 114908476
N-(2-amino-2-sulfanylideneethyl)-N-methyl-4-propylthiadiazole-5-carboxamide
CID 65204972
N-ethyl-N-(2-hydroxyethyl)thiadiazole-4-carboxamide
CID 61067354
N-[[4-(4-hydroxybut-1-ynyl)phenyl]methyl]-N-methylthiadiazole-4-carboxamide
CID 65216344
(thiadiazole-4-carbonylamino)thiourea
CID 65216202
N-[[4-(4-hydroxybut-1-ynyl)thiophen-2-yl]methyl]-N-methylthiadiazole-4-carboxamide
CID 65216559

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide?
The IUPAC name of N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide (CID 65216482) is N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide.
What is the SMILES notation for N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide?
The canonical SMILES for N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide is CN(CC(N)=S)C(=O)c1csnn1.
What is the InChIKey of N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide?
The InChIKey is LRMGDRSJAGAGTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4OS2/c1-10(2-5(7)12)6(11)4-3-13-9-8-4/h3H,2H2,1H3,(H2,7,12).
What are the key properties of N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide?
N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide has a molecular weight of 216.29 g/mol, XLogP of -0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-sulfanylideneethyl)-N-methylthiadiazole-4-carboxamide is sourced from PubChem (CID 65216482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).