1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine

C7H10N6S — CID 83834802

IUPAC1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine
SMILESCC(N)CNc1ncc2nnsc2n1
InChIInChI=1S/C7H10N6S/c1-4(8)2-9-7-10-3-5-6(11-7)14-13-12-5/h3-4H,2,8H2,1H3,(H,9,10,11)
InChIKeyGSTDOSSWLCSPQE-UHFFFAOYSA-N
MW210.27 g/mol
LogP0.24
Rot. Bonds3

About 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine

1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine (PubChem CID 83834802) has the molecular formula C7H10N6S and a molecular weight of 210.27 g/mol. Its IUPAC name is 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine.

Molecular Properties

Compound Name1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine
PubChem CID83834802
Molecular FormulaC7H10N6S
Molecular Weight210.27 g/mol
Exact Mass210.07
IUPAC Name1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine
SMILESCC(N)CNc1ncc2nnsc2n1
InChIInChI=1S/C7H10N6S/c1-4(8)2-9-7-10-3-5-6(11-7)14-13-12-5/h3-4H,2,8H2,1H3,(H,9,10,11)
InChIKeyGSTDOSSWLCSPQE-UHFFFAOYSA-N
XLogP0.24
TPSA89.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine 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

5-propan-2-ylthiadiazolo[5,4-d]pyrimidine
CID 130231920
1-N-(5-fluoropyrimidin-2-yl)propane-1,2-diamine
CID 104606339
2-N,4-N,6-N-tris(2-aminopropyl)-1,3,5-triazine-2,4,6-triamine
CID 59765899
1-N-(5-ethylpyrimidin-2-yl)propane-1,2-diamine
CID 116974283
1-N-(3-methyl-[1,2]oxazolo[4,5-d]pyrimidin-5-yl)propane-1,2-diamine
CID 83833739
2-(2-aminopropylamino)-4-(cyclohexylamino)pyrimidine-5-carboxamide
CID 70981953
1-N-[5-(3H-benzimidazol-5-yl)pyrimidin-2-yl]propane-1,2-diamine
CID 116974313
2-(2-aminopropylamino)-4-(4-methylanilino)pyrimidine-5-carboxamide
CID 78119144
2-[[(2S)-2-aminopropyl]amino]-4-[4-(thiadiazol-4-yl)anilino]pyrimidine-5-carboxamide
CID 59199697
1-N-[5-(5-bromo-2-fluorophenyl)pyrimidin-2-yl]propane-1,2-diamine
CID 116974314
1-N-[5-(4-fluorophenyl)-4-pyridin-4-ylpyrimidin-2-yl]propane-1,2-diamine
CID 152579208
3-amino-4-[(5-methylpyrimidin-2-yl)amino]butan-2-ol
CID 64540641

Frequently Asked Questions

What is the IUPAC name of 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine?
The IUPAC name of 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine (CID 83834802) is 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine.
What is the SMILES notation for 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine?
The canonical SMILES for 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine is CC(N)CNc1ncc2nnsc2n1.
What is the InChIKey of 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine?
The InChIKey is GSTDOSSWLCSPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N6S/c1-4(8)2-9-7-10-3-5-6(11-7)14-13-12-5/h3-4H,2,8H2,1H3,(H,9,10,11).
What are the key properties of 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine?
1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine has a molecular weight of 210.27 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(thiadiazolo[5,4-d]pyrimidin-5-yl)propane-1,2-diamine is sourced from PubChem (CID 83834802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).