3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide

C15H19N5O3S — CID 74236471

IUPAC3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
SMILESO=C(NCCS(=O)(=O)N1CCCC1)c1cc(-c2ccncc2)n[nH]1
InChIInChI=1S/C15H19N5O3S/c21-15(17-7-10-24(22,23)20-8-1-2-9-20)14-11-13(18-19-14)12-3-5-16-6-4-12/h3-6,11H,1-2,7-10H2,(H,17,21)(H,18,19)
InChIKeyAQXOBOXRZJBKMM-UHFFFAOYSA-N
MW349.42 g/mol
LogP0.63
Rot. Bonds6

About 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide

3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide (PubChem CID 74236471) has the molecular formula C15H19N5O3S and a molecular weight of 349.42 g/mol. Its IUPAC name is 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
PubChem CID74236471
Molecular FormulaC15H19N5O3S
Molecular Weight349.42 g/mol
Exact Mass349.12
IUPAC Name3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
SMILESO=C(NCCS(=O)(=O)N1CCCC1)c1cc(-c2ccncc2)n[nH]1
InChIInChI=1S/C15H19N5O3S/c21-15(17-7-10-24(22,23)20-8-1-2-9-20)14-11-13(18-19-14)12-3-5-16-6-4-12/h3-6,11H,1-2,7-10H2,(H,17,21)(H,18,19)
InChIKeyAQXOBOXRZJBKMM-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

Analyze 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide 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-pyridin-2-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
CID 74249644
3-(1,3-dimethylpyrazol-4-yl)-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide
CID 46978635
3-pyridin-4-yl-N-[2-(4-sulfamoylphenyl)ethyl]-1H-pyrazole-5-carboxamide
CID 110676548
N-[2-[(3S)-oxan-3-yl]ethyl]-3-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 125441800
N-benzyl-3-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 53087401
N-propan-2-yl-3-pyridin-4-yl-1H-pyrazole-5-carboxamide
CID 53014349
3-phenyl-N-(2-piperidin-1-ylsulfonylethyl)benzamide
CID 110287574
3-(4-methoxyphenyl)-N-(2-pyrrolidin-1-ylethyl)-1H-pyrazole-5-carboxamide
CID 70721553
2-methyl-N-(2-pyrrolidin-1-ylsulfonylethyl)benzamide
CID 110345334
N-[4-(azepan-1-yl)butyl]-3-(4-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 70712358
N-[2-(azepan-1-ylsulfonyl)ethyl]-3-chlorobenzamide
CID 110346034
2-[(3-phenyl-1H-pyrazole-5-carbonyl)amino]ethylcarbamic acid
CID 118877078

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide (CID 74236471) is 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide is O=C(NCCS(=O)(=O)N1CCCC1)c1cc(-c2ccncc2)n[nH]1.
What is the InChIKey of 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
The InChIKey is AQXOBOXRZJBKMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3S/c21-15(17-7-10-24(22,23)20-8-1-2-9-20)14-11-13(18-19-14)12-3-5-16-6-4-12/h3-6,11H,1-2,7-10H2,(H,17,21)(H,18,19).
What are the key properties of 3-pyridin-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide?
3-pyridin-4-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-4-yl-N-(2-pyrrolidin-1-ylsulfonylethyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 74236471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).