4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine

C5H9N3S — CID 89022486

IUPAC4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine
SMILESCNc1ncsc1NC
InChIInChI=1S/C5H9N3S/c1-6-4-5(7-2)9-3-8-4/h3,6-7H,1-2H3
InChIKeyWBUQBIIDEFDEFF-UHFFFAOYSA-N
MW143.21 g/mol
LogP1.23
Rot. Bonds2

About 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine

4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine (PubChem CID 89022486) has the molecular formula C5H9N3S and a molecular weight of 143.21 g/mol. Its IUPAC name is 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine.

Molecular Properties

Compound Name4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine
PubChem CID89022486
Molecular FormulaC5H9N3S
Molecular Weight143.21 g/mol
Exact Mass143.05
IUPAC Name4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine
SMILESCNc1ncsc1NC
InChIInChI=1S/C5H9N3S/c1-6-4-5(7-2)9-3-8-4/h3,6-7H,1-2H3
InChIKeyWBUQBIIDEFDEFF-UHFFFAOYSA-N
XLogP1.23
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.21
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine?
The IUPAC name of 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine (CID 89022486) is 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine.
What is the SMILES notation for 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine?
The canonical SMILES for 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine is CNc1ncsc1NC.
What is the InChIKey of 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine?
The InChIKey is WBUQBIIDEFDEFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S/c1-6-4-5(7-2)9-3-8-4/h3,6-7H,1-2H3.
What are the key properties of 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine?
4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine has a molecular weight of 143.21 g/mol, XLogP of 1.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,5-N-dimethyl-1,3-thiazole-4,5-diamine is sourced from PubChem (CID 89022486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).