4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine

C8H12N8S2 — CID 80923103

IUPAC4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine
SMILESCc1nnc(Sc2nc(NN)nc(N(C)C)n2)s1
InChIInChI=1S/C8H12N8S2/c1-4-14-15-8(17-4)18-7-11-5(13-9)10-6(12-7)16(2)3/h9H2,1-3H3,(H,10,11,12,13)
InChIKeyVERKQOGTDCSISQ-UHFFFAOYSA-N
MW284.37 g/mol
LogP0.53
Rot. Bonds4

About 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine

4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine (PubChem CID 80923103) has the molecular formula C8H12N8S2 and a molecular weight of 284.37 g/mol. Its IUPAC name is 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine
PubChem CID80923103
Molecular FormulaC8H12N8S2
Molecular Weight284.37 g/mol
Exact Mass284.06
IUPAC Name4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine
SMILESCc1nnc(Sc2nc(NN)nc(N(C)C)n2)s1
InChIInChI=1S/C8H12N8S2/c1-4-14-15-8(17-4)18-7-11-5(13-9)10-6(12-7)16(2)3/h9H2,1-3H3,(H,10,11,12,13)
InChIKeyVERKQOGTDCSISQ-UHFFFAOYSA-N
XLogP0.53
TPSA105.74 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine (CID 80923103) is 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine is Cc1nnc(Sc2nc(NN)nc(N(C)C)n2)s1.
What is the InChIKey of 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine?
The InChIKey is VERKQOGTDCSISQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N8S2/c1-4-14-15-8(17-4)18-7-11-5(13-9)10-6(12-7)16(2)3/h9H2,1-3H3,(H,10,11,12,13).
What are the key properties of 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine?
4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine has a molecular weight of 284.37 g/mol, XLogP of 0.53, 4 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N,N-dimethyl-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 80923103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).