N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide

C17H19N5O2S — CID 133361525

IUPACN-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide
SMILESCNS(=O)(=O)c1ccc(NC(C)c2ccccc2-n2cccn2)nc1
InChIInChI=1S/C17H19N5O2S/c1-13(15-6-3-4-7-16(15)22-11-5-10-20-22)21-17-9-8-14(12-19-17)25(23,24)18-2/h3-13,18H,1-2H3,(H,19,21)
InChIKeyGIIXLZKIBSNBRW-UHFFFAOYSA-N
MW357.44 g/mol
LogP2.35
Rot. Bonds6

About N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide

N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide (PubChem CID 133361525) has the molecular formula C17H19N5O2S and a molecular weight of 357.44 g/mol. Its IUPAC name is N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide
PubChem CID133361525
Molecular FormulaC17H19N5O2S
Molecular Weight357.44 g/mol
Exact Mass357.13
IUPAC NameN-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide
SMILESCNS(=O)(=O)c1ccc(NC(C)c2ccccc2-n2cccn2)nc1
InChIInChI=1S/C17H19N5O2S/c1-13(15-6-3-4-7-16(15)22-11-5-10-20-22)21-17-9-8-14(12-19-17)25(23,24)18-2/h3-13,18H,1-2H3,(H,19,21)
InChIKeyGIIXLZKIBSNBRW-UHFFFAOYSA-N
XLogP2.35
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.44
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-nitro-N-[1-(2-pyrazol-1-ylphenyl)ethyl]imidazo[1,2-b]pyridazin-6-amine
CID 133420153
6-[1-(4-bromophenyl)ethylamino]-N-methylpyridine-3-sulfonamide
CID 133299268
N-ethyl-1-(2-pyrazol-1-ylphenyl)ethanamine
CID 43284732
N-propan-2-yl-2-[[(1S)-1-(2-pyrazol-1-ylphenyl)ethyl]amino]acetamide
CID 97085171
N-[(1S)-1-(2-pyrazol-1-ylphenyl)ethyl]cyclopentanamine
CID 95132547
N-(2-phenylethyl)-1-(2-pyrazol-1-ylphenyl)ethanamine
CID 71862790
5-methyl-N-[1-(2-pyrazol-1-ylphenyl)ethyl]quinazolin-4-amine
CID 133361511
7-chloro-N-[1-(2-pyrazol-1-ylphenyl)ethyl]quinazolin-4-amine
CID 133361537
2-methyl-3-oxo-3-[1-(2-pyrazol-1-ylphenyl)ethylamino]propanoic acid
CID 122065751
N-methyl-6-[(1-phenyl-2-pyrrolidin-1-ylethyl)amino]pyridine-3-sulfonamide
CID 133316598
1-[1-(2-pyrazol-1-ylphenyl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 120550077
N-(2-hydroxyethyl)-4-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-2-carboxamide
CID 56906118

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide?
The IUPAC name of N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide (CID 133361525) is N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide.
What is the SMILES notation for N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide?
The canonical SMILES for N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide is CNS(=O)(=O)c1ccc(NC(C)c2ccccc2-n2cccn2)nc1.
What is the InChIKey of N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide?
The InChIKey is GIIXLZKIBSNBRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5O2S/c1-13(15-6-3-4-7-16(15)22-11-5-10-20-22)21-17-9-8-14(12-19-17)25(23,24)18-2/h3-13,18H,1-2H3,(H,19,21).
What are the key properties of N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide?
N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide has a molecular weight of 357.44 g/mol, XLogP of 2.35, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[1-(2-pyrazol-1-ylphenyl)ethylamino]pyridine-3-sulfonamide is sourced from PubChem (CID 133361525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).