N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide

C11H12N4O2S — CID 62353333

IUPACN-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide
SMILESNCc1ccc(NS(=O)(=O)c2cccnc2)nc1
InChIInChI=1S/C11H12N4O2S/c12-6-9-3-4-11(14-7-9)15-18(16,17)10-2-1-5-13-8-10/h1-5,7-8H,6,12H2,(H,14,15)
InChIKeyZRSDJXBXUPILIP-UHFFFAOYSA-N
MW264.31 g/mol
LogP0.74
Rot. Bonds4

About N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide

N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide (PubChem CID 62353333) has the molecular formula C11H12N4O2S and a molecular weight of 264.31 g/mol. Its IUPAC name is N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide
PubChem CID62353333
Molecular FormulaC11H12N4O2S
Molecular Weight264.31 g/mol
Exact Mass264.07
IUPAC NameN-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide
SMILESNCc1ccc(NS(=O)(=O)c2cccnc2)nc1
InChIInChI=1S/C11H12N4O2S/c12-6-9-3-4-11(14-7-9)15-18(16,17)10-2-1-5-13-8-10/h1-5,7-8H,6,12H2,(H,14,15)
InChIKeyZRSDJXBXUPILIP-UHFFFAOYSA-N
XLogP0.74
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.31
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(aminomethyl)-2-pyridinyl]-1-methylpyrazole-4-sulfonamide
CID 62353719
5-(aminomethyl)-N-(ethylsulfamoyl)pyridin-2-amine
CID 114803951
N-[5-(aminomethyl)-2-pyridinyl]-2-methylpropane-2-sulfonamide
CID 63687650
N-[4-(chloromethyl)phenyl]pyridine-3-sulfonamide
CID 65031220
N-(6-phenylpyridazin-3-yl)pyridine-3-sulfonamide
CID 86806095
N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 91625946
N-(4-cyano-2-pyridinyl)pyridine-3-sulfonamide
CID 86819051
N-(4-aminobutyl)pyridine-3-sulfonamide
CID 60893787
N-(6-pyrazol-1-ylpyrimidin-4-yl)pyridine-3-sulfonamide
CID 121135032
N-[5-[2-[2,6-difluoro-3-(pyridin-3-ylsulfonylamino)phenyl]-2-oxoethyl]-2-pyridinyl]acetamide
CID 147217338
N-(2-bromo-3-pyridinyl)pyridine-3-sulfonamide
CID 103816034
N-(3-amino-2,2-dimethylpropyl)pyridine-3-sulfonamide
CID 115365958

Frequently Asked Questions

What is the IUPAC name of N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide?
The IUPAC name of N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide (CID 62353333) is N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide?
The canonical SMILES for N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide is NCc1ccc(NS(=O)(=O)c2cccnc2)nc1.
What is the InChIKey of N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide?
The InChIKey is ZRSDJXBXUPILIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4O2S/c12-6-9-3-4-11(14-7-9)15-18(16,17)10-2-1-5-13-8-10/h1-5,7-8H,6,12H2,(H,14,15).
What are the key properties of N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide?
N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide has a molecular weight of 264.31 g/mol, XLogP of 0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide is sourced from PubChem (CID 62353333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).