4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine

C7H14N4S — CID 62183925

IUPAC4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine
SMILESCCNc1snnc1CN(C)C
InChIInChI=1S/C7H14N4S/c1-4-8-7-6(5-11(2)3)9-10-12-7/h8H,4-5H2,1-3H3
InChIKeyZIJDFSNUULRYAJ-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.03
Rot. Bonds4

About 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine

4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine (PubChem CID 62183925) has the molecular formula C7H14N4S and a molecular weight of 186.28 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine
PubChem CID62183925
Molecular FormulaC7H14N4S
Molecular Weight186.28 g/mol
Exact Mass186.09
IUPAC Name4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine
SMILESCCNc1snnc1CN(C)C
InChIInChI=1S/C7H14N4S/c1-4-8-7-6(5-11(2)3)9-10-12-7/h8H,4-5H2,1-3H3
InChIKeyZIJDFSNUULRYAJ-UHFFFAOYSA-N
XLogP1.03
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine 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 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine?
The IUPAC name of 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine (CID 62183925) is 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine.
What is the SMILES notation for 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine?
The canonical SMILES for 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine is CCNc1snnc1CN(C)C.
What is the InChIKey of 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine?
The InChIKey is ZIJDFSNUULRYAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N4S/c1-4-8-7-6(5-11(2)3)9-10-12-7/h8H,4-5H2,1-3H3.
What are the key properties of 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine?
4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine has a molecular weight of 186.28 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-N-ethylthiadiazol-5-amine is sourced from PubChem (CID 62183925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).