N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide

C16H20N4O2S — CID 134570059

IUPACN-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NS(=O)C1CCC1)c1cnn2ccc(N3CCCC3)cc12
InChIInChI=1S/C16H20N4O2S/c21-16(18-23(22)13-4-3-5-13)14-11-17-20-9-6-12(10-15(14)20)19-7-1-2-8-19/h6,9-11,13H,1-5,7-8H2,(H,18,21)
InChIKeyGTDJWTKTICQCBV-UHFFFAOYSA-N
MW332.43 g/mol
LogP1.88
Rot. Bonds4

About N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide

N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 134570059) has the molecular formula C16H20N4O2S and a molecular weight of 332.43 g/mol. Its IUPAC name is N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID134570059
Molecular FormulaC16H20N4O2S
Molecular Weight332.43 g/mol
Exact Mass332.13
IUPAC NameN-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NS(=O)C1CCC1)c1cnn2ccc(N3CCCC3)cc12
InChIInChI=1S/C16H20N4O2S/c21-16(18-23(22)13-4-3-5-13)14-11-17-20-9-6-12(10-15(14)20)19-7-1-2-8-19/h6,9-11,13H,1-5,7-8H2,(H,18,21)
InChIKeyGTDJWTKTICQCBV-UHFFFAOYSA-N
XLogP1.88
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide (CID 134570059) is N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide is O=C(NS(=O)C1CCC1)c1cnn2ccc(N3CCCC3)cc12.
What is the InChIKey of N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is GTDJWTKTICQCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2S/c21-16(18-23(22)13-4-3-5-13)14-11-17-20-9-6-12(10-15(14)20)19-7-1-2-8-19/h6,9-11,13H,1-5,7-8H2,(H,18,21).
What are the key properties of N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide?
N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 332.43 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutylsulfinyl-5-pyrrolidin-1-ylpyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 134570059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).