2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide

C11H15N5O2S — CID 106217947

IUPAC2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NC(C)c1cn[nH]c1
InChIInChI=1S/C11H15N5O2S/c1-8(9-6-14-15-7-9)16-19(17,18)10-4-3-5-13-11(10)12-2/h3-8,16H,1-2H3,(H,12,13)(H,14,15)
InChIKeyIANUZROHMVOPQK-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.89
Rot. Bonds5

About 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide

2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide (PubChem CID 106217947) 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-3-sulfonamide.

Molecular Properties

Compound Name2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide
PubChem CID106217947
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC Name2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NC(C)c1cn[nH]c1
InChIInChI=1S/C11H15N5O2S/c1-8(9-6-14-15-7-9)16-19(17,18)10-4-3-5-13-11(10)12-2/h3-8,16H,1-2H3,(H,12,13)(H,14,15)
InChIKeyIANUZROHMVOPQK-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

2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-4-sulfonamide
CID 106217923
N-methyl-2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]propanamide
CID 62159401
N-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-(methylamino)pyridine-3-sulfonamide
CID 79231400
2-(methylamino)-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]pyridine-3-sulfonamide
CID 62145827
2-(3-hydroxyprop-1-ynyl)-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106217870
5-amino-2,3-dimethyl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106208351
2,5-dichloro-N-[1-(1H-pyrazol-4-yl)ethyl]thiophene-3-sulfonamide
CID 103854257
2-(methylamino)-N-(4-methylsulfanylbutan-2-yl)pyridine-3-sulfonamide
CID 113478168
4-amino-2-methoxy-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106208333
2-amino-N-[(1S)-1-phenylethyl]pyridine-3-sulfonamide
CID 107864042
4-butan-2-yl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 103854220
N-(1-cyclopropylbutan-2-yl)-2-(methylamino)pyridine-3-sulfonamide
CID 63995591

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide?
The IUPAC name of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide (CID 106217947) is 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide is CNc1ncccc1S(=O)(=O)NC(C)c1cn[nH]c1.
What is the InChIKey of 2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-sulfonamide?
The InChIKey is IANUZROHMVOPQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-8(9-6-14-15-7-9)16-19(17,18)10-4-3-5-13-11(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-3-sulfonamide?
2-(methylamino)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-3-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-3-sulfonamide is sourced from PubChem (CID 106217947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).