2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide

C11H15N5O2S — CID 106217923

IUPAC2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)NC(C)c2cn[nH]c2)ccn1
InChIInChI=1S/C11H15N5O2S/c1-8(9-6-14-15-7-9)16-19(17,18)10-3-4-13-11(5-10)12-2/h3-8,16H,1-2H3,(H,12,13)(H,14,15)
InChIKeyBTOGBQYJNLFCNX-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.89
Rot. Bonds5

About 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide

2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide (PubChem CID 106217923) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide
PubChem CID106217923
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC Name2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)NC(C)c2cn[nH]c2)ccn1
InChIInChI=1S/C11H15N5O2S/c1-8(9-6-14-15-7-9)16-19(17,18)10-3-4-13-11(5-10)12-2/h3-8,16H,1-2H3,(H,12,13)(H,14,15)
InChIKeyBTOGBQYJNLFCNX-UHFFFAOYSA-N
XLogP0.89
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-difluoro-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 103854165
3-amino-4-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106208367
2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide
CID 106217947
3-amino-4-bromo-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106208303
4-butan-2-yl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 103854220
2-hydrazinyl-N-(1-pyridin-4-ylethyl)pyridine-4-sulfonamide
CID 61003919
2-hydroxy-5-[1-(1H-pyrazol-4-yl)ethylsulfamoyl]benzoic acid
CID 106208820
2-(methylamino)-N-(4-methylpentan-2-yl)pyridine-4-sulfonamide
CID 55044390
5-(methylaminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]-1H-pyrrole-3-sulfonamide
CID 106218637
3-propanoyl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 103854212
2-bromo-5-[1-(1H-pyrazol-4-yl)ethylsulfamoyl]benzoic acid
CID 106208908
3-amino-5-fluoro-4-methoxy-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106208377

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide?
The IUPAC name of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide (CID 106217923) is 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)NC(C)c2cn[nH]c2)ccn1.
What is the InChIKey of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide?
The InChIKey is BTOGBQYJNLFCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-8(9-6-14-15-7-9)16-19(17,18)10-3-4-13-11(5-10)12-2/h3-8,16H,1-2H3,(H,12,13)(H,14,15).
What are the key properties of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide?
2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 0.89, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide is sourced from PubChem (CID 106217923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).