N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide

C10H13N5O2S — CID 91629189

IUPACN-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide
SMILESO=S(=O)(Nc1cnc2ccnn2c1)N1CCCC1
InChIInChI=1S/C10H13N5O2S/c16-18(17,14-5-1-2-6-14)13-9-7-11-10-3-4-12-15(10)8-9/h3-4,7-8,13H,1-2,5-6H2
InChIKeyLKMBBIJSGFBJKS-UHFFFAOYSA-N
MW267.31 g/mol
LogP0.48
Rot. Bonds3

About N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide

N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide (PubChem CID 91629189) has the molecular formula C10H13N5O2S and a molecular weight of 267.31 g/mol. Its IUPAC name is N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide
PubChem CID91629189
Molecular FormulaC10H13N5O2S
Molecular Weight267.31 g/mol
Exact Mass267.08
IUPAC NameN-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide
SMILESO=S(=O)(Nc1cnc2ccnn2c1)N1CCCC1
InChIInChI=1S/C10H13N5O2S/c16-18(17,14-5-1-2-6-14)13-9-7-11-10-3-4-12-15(10)8-9/h3-4,7-8,13H,1-2,5-6H2
InChIKeyLKMBBIJSGFBJKS-UHFFFAOYSA-N
XLogP0.48
TPSA79.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.31
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide?
The IUPAC name of N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide (CID 91629189) is N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide.
What is the SMILES notation for N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide?
The canonical SMILES for N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide is O=S(=O)(Nc1cnc2ccnn2c1)N1CCCC1.
What is the InChIKey of N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide?
The InChIKey is LKMBBIJSGFBJKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2S/c16-18(17,14-5-1-2-6-14)13-9-7-11-10-3-4-12-15(10)8-9/h3-4,7-8,13H,1-2,5-6H2.
What are the key properties of N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide?
N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide has a molecular weight of 267.31 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrazolo[1,5-a]pyrimidin-6-ylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 91629189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).