guanidine;thiadiazole

C3H7N5S — CID 23337144

IUPACguanidine;thiadiazole
SMILES[H]N=C(N)N.c1csnn1
InChIInChI=1S/C2H2N2S.CH5N3/c1-2-5-4-3-1;2-1(3)4/h1-2H;(H5,2,3,4)
InChIKeyGYXNSSMABGXHNL-UHFFFAOYSA-N
MW145.19 g/mol
LogP-0.62
Rot. Bonds

About guanidine;thiadiazole

guanidine;thiadiazole (PubChem CID 23337144) has the molecular formula C3H7N5S and a molecular weight of 145.19 g/mol. Its IUPAC name is guanidine;thiadiazole.

Molecular Properties

Compound Nameguanidine;thiadiazole
PubChem CID23337144
Molecular FormulaC3H7N5S
Molecular Weight145.19 g/mol
Exact Mass145.04
IUPAC Nameguanidine;thiadiazole
SMILES[H]N=C(N)N.c1csnn1
InChIInChI=1S/C2H2N2S.CH5N3/c1-2-5-4-3-1;2-1(3)4/h1-2H;(H5,2,3,4)
InChIKeyGYXNSSMABGXHNL-UHFFFAOYSA-N
XLogP-0.62
TPSA101.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.19
LogP ≤ 5-0.62
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of guanidine;thiadiazole?
The IUPAC name of guanidine;thiadiazole (CID 23337144) is guanidine;thiadiazole.
What is the SMILES notation for guanidine;thiadiazole?
The canonical SMILES for guanidine;thiadiazole is [H]N=C(N)N.c1csnn1.
What is the InChIKey of guanidine;thiadiazole?
The InChIKey is GYXNSSMABGXHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N2S.CH5N3/c1-2-5-4-3-1;2-1(3)4/h1-2H;(H5,2,3,4).
What are the key properties of guanidine;thiadiazole?
guanidine;thiadiazole has a molecular weight of 145.19 g/mol, XLogP of -0.62, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for guanidine;thiadiazole is sourced from PubChem (CID 23337144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).