4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol

C7H10N2S — CID 142909383

IUPAC4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol
SMILESSc1cnn2c1CCCC2
InChIInChI=1S/C7H10N2S/c10-7-5-8-9-4-2-1-3-6(7)9/h5,10H,1-4H2
InChIKeyUNFNOGXXGKFOCA-UHFFFAOYSA-N
MW154.24 g/mol
LogP1.51
Rot. Bonds

About 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol

4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol (PubChem CID 142909383) has the molecular formula C7H10N2S and a molecular weight of 154.24 g/mol. Its IUPAC name is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol.

Molecular Properties

Compound Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol
PubChem CID142909383
Molecular FormulaC7H10N2S
Molecular Weight154.24 g/mol
Exact Mass154.06
IUPAC Name4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol
SMILESSc1cnn2c1CCCC2
InChIInChI=1S/C7H10N2S/c10-7-5-8-9-4-2-1-3-6(7)9/h5,10H,1-4H2
InChIKeyUNFNOGXXGKFOCA-UHFFFAOYSA-N
XLogP1.51
TPSA17.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

3-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 14145814
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-ylboronic acid
CID 66764821
ethane;3-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepine
CID 145221540
CID 163427439
CID 163427439
3-chloro-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
CID 122129707
ethane;3-methyl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
CID 142324749
3-propyl-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
CID 163670178
4-methyl-6-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)pyridin-2-amine
CID 89493420
3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)butanoic acid
CID 83883806
[3-hydroxy-3-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-3-yl)propyl]-trimethylazanium
CID 70236354
3-(4-fluorophenyl)-5,6-dihydro-4H-pyrrolo[2,1-e]pyrazole
CID 71531119
1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carbonylamino)cyclobutane-1-carboxylic acid
CID 120530814

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol?
The IUPAC name of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol (CID 142909383) is 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol.
What is the SMILES notation for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol?
The canonical SMILES for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol is Sc1cnn2c1CCCC2.
What is the InChIKey of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol?
The InChIKey is UNFNOGXXGKFOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2S/c10-7-5-8-9-4-2-1-3-6(7)9/h5,10H,1-4H2.
What are the key properties of 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol?
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol has a molecular weight of 154.24 g/mol, XLogP of 1.51, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-thiol is sourced from PubChem (CID 142909383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).