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

C11H15N5O2S — CID 106218530

IUPAC5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CN)cn1)c1cn[nH]c1
InChIInChI=1S/C11H15N5O2S/c1-8(10-6-14-15-7-10)16-19(17,18)11-3-2-9(4-12)5-13-11/h2-3,5-8,16H,4,12H2,1H3,(H,14,15)
InChIKeyGXHHGAJARHTDJZ-UHFFFAOYSA-N
MW281.34 g/mol
LogP0.30
Rot. Bonds5

About 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide

5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide (PubChem CID 106218530) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide
PubChem CID106218530
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC Name5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ccc(CN)cn1)c1cn[nH]c1
InChIInChI=1S/C11H15N5O2S/c1-8(10-6-14-15-7-10)16-19(17,18)11-3-2-9(4-12)5-13-11/h2-3,5-8,16H,4,12H2,1H3,(H,14,15)
InChIKeyGXHHGAJARHTDJZ-UHFFFAOYSA-N
XLogP0.30
TPSA113.76 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 ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-2-bromo-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106218634
4-(aminomethyl)-2-chloro-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106217429
5-(aminomethyl)-N-(1-pyridin-2-ylethyl)pyridine-2-sulfonamide
CID 106022983
3-(aminomethyl)-2,4-dichloro-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106218593
5-(aminomethyl)-N-[1-(diethylamino)propan-2-yl]pyridine-2-sulfonamide
CID 106052257
4-butan-2-yl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 103854220
5-(aminomethyl)-N-(1-cyclopropylbutan-2-yl)pyridine-2-sulfonamide
CID 106064004
5-(hydroxymethyl)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-2-sulfonamide
CID 106283934
3-(aminomethyl)-2,5-dichloro-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106218611
1-chloro-N-[1-(1H-pyrazol-4-yl)ethyl]methanesulfonamide
CID 106216702
3-amino-4-methyl-N-[1-(1H-pyrazol-4-yl)ethyl]benzenesulfonamide
CID 106208367
5-(hydroxymethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]furan-2-sulfonamide
CID 106218370

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide (CID 106218530) is 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide is CC(NS(=O)(=O)c1ccc(CN)cn1)c1cn[nH]c1.
What is the InChIKey of 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide?
The InChIKey is GXHHGAJARHTDJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-8(10-6-14-15-7-10)16-19(17,18)11-3-2-9(4-12)5-13-11/h2-3,5-8,16H,4,12H2,1H3,(H,14,15).
What are the key properties of 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide?
5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 0.30, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-[1-(1H-pyrazol-4-yl)ethyl]pyridine-2-sulfonamide is sourced from PubChem (CID 106218530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).