3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide

C15H19N5O3S — CID 74249644

IUPAC3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
SMILESO=C(NCCS(=O)(=O)N1CCCC1)c1cc(-c2ccccn2)n[nH]1
InChIInChI=1S/C15H19N5O3S/c21-15(17-7-10-24(22,23)20-8-3-4-9-20)14-11-13(18-19-14)12-5-1-2-6-16-12/h1-2,5-6,11H,3-4,7-10H2,(H,17,21)(H,18,19)
InChIKeyATRMCKQYQCTIGC-UHFFFAOYSA-N
MW349.42 g/mol
LogP0.63
Rot. Bonds6

About 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide

3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide (PubChem CID 74249644) has the molecular formula C15H19N5O3S and a molecular weight of 349.42 g/mol. Its IUPAC name is 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
PubChem CID74249644
Molecular FormulaC15H19N5O3S
Molecular Weight349.42 g/mol
Exact Mass349.12
IUPAC Name3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
SMILESO=C(NCCS(=O)(=O)N1CCCC1)c1cc(-c2ccccn2)n[nH]1
InChIInChI=1S/C15H19N5O3S/c21-15(17-7-10-24(22,23)20-8-3-4-9-20)14-11-13(18-19-14)12-5-1-2-6-16-12/h1-2,5-6,11H,3-4,7-10H2,(H,17,21)(H,18,19)
InChIKeyATRMCKQYQCTIGC-UHFFFAOYSA-N
XLogP0.63
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
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3-(1,3-dimethylpyrazol-4-yl)-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
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4-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)pyrimidin-2-amine
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N-benzyl-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
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N-(2-imidazol-1-ylethyl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
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N-(3-cyclohexyloxypropyl)-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
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3-phenyl-N-(2-piperidin-1-ylsulfonylethyl)benzamide
CID 110287574
N-[(2S)-2-morpholin-4-ylpropyl]-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 92612749
2-methyl-N-(2-pyrrolidin-1-ylsulfonylethyl)benzamide
CID 110345334
N-[2-(azepan-1-ylsulfonyl)ethyl]-3-chlorobenzamide
CID 110346034
N-[2-(1H-benzimidazol-2-yl)ethyl]-3-pyridin-2-yl-1H-pyrazole-5-carboxamide
CID 110204460
2-(2-methylprop-2-enoxy)-N-(2-pyrrolidin-1-ylsulfonylethyl)benzamide
CID 46994853

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide (CID 74249644) is 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide is O=C(NCCS(=O)(=O)N1CCCC1)c1cc(-c2ccccn2)n[nH]1.
What is the InChIKey of 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
The InChIKey is ATRMCKQYQCTIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3S/c21-15(17-7-10-24(22,23)20-8-3-4-9-20)14-11-13(18-19-14)12-5-1-2-6-16-12/h1-2,5-6,11H,3-4,7-10H2,(H,17,21)(H,18,19).
What are the key properties of 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide has a molecular weight of 349.42 g/mol, XLogP of 0.63, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 74249644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).