3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol

C10H13N3OS — CID 115372691

IUPAC3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol
SMILESCC(CCO)Sc1ccn2nccc2n1
InChIInChI=1S/C10H13N3OS/c1-8(4-7-14)15-10-3-6-13-9(12-10)2-5-11-13/h2-3,5-6,8,14H,4,7H2,1H3
InChIKeyMUPCNPHMAMPUOC-UHFFFAOYSA-N
MW223.30 g/mol
LogP1.59
Rot. Bonds4

About 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol

3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol (PubChem CID 115372691) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol.

Molecular Properties

Compound Name3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol
PubChem CID115372691
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC Name3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol
SMILESCC(CCO)Sc1ccn2nccc2n1
InChIInChI=1S/C10H13N3OS/c1-8(4-7-14)15-10-3-6-13-9(12-10)2-5-11-13/h2-3,5-6,8,14H,4,7H2,1H3
InChIKeyMUPCNPHMAMPUOC-UHFFFAOYSA-N
XLogP1.59
TPSA50.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol 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

3-(2-aminopyrimidin-4-yl)sulfanylbutan-1-ol
CID 80890575
N-(1-hydroxy-4-methylpentan-3-yl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 126834527
2-[propan-2-yl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]ethanol
CID 115372880
3-pyrazolo[1,5-a]pyrimidin-5-ylpentan-2-ol
CID 115373137
3-pyrazin-2-ylsulfanylbutan-1-ol
CID 66138101
2-(4-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylphenyl)acetic acid
CID 115372236
3-[(4-amino-6-pyrazol-1-yl-1,3,5-triazin-2-yl)sulfanyl]butan-1-ol
CID 80891108
3-[2-methyl-6-(methylamino)pyrimidin-4-yl]sulfanylbutan-1-ol
CID 80890129
3-hydroxy-2-pyrazolo[1,5-a]pyrimidin-5-ylpropanenitrile
CID 115373174
3-[(3-methyl-2-pyridinyl)sulfanyl]butan-1-ol
CID 66136520
2-[2-[methyl(pyrazolo[1,5-a]pyrimidin-5-yl)amino]ethoxy]ethanol
CID 114243521
N-propan-2-yl-2-(pyrazolo[1,5-a]pyrimidin-5-ylamino)acetamide
CID 113296656

Frequently Asked Questions

What is the IUPAC name of 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol?
The IUPAC name of 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol (CID 115372691) is 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol.
What is the SMILES notation for 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol?
The canonical SMILES for 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol is CC(CCO)Sc1ccn2nccc2n1.
What is the InChIKey of 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol?
The InChIKey is MUPCNPHMAMPUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c1-8(4-7-14)15-10-3-6-13-9(12-10)2-5-11-13/h2-3,5-6,8,14H,4,7H2,1H3.
What are the key properties of 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol?
3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol has a molecular weight of 223.30 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazolo[1,5-a]pyrimidin-5-ylsulfanylbutan-1-ol is sourced from PubChem (CID 115372691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).