2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide

C14H23N3O2S — CID 106594093

IUPAC2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCCC(N(C)S(=O)(=O)c2cccnc2CN)C1
InChIInChI=1S/C14H23N3O2S/c1-11-5-3-6-12(9-11)17(2)20(18,19)14-7-4-8-16-13(14)10-15/h4,7-8,11-12H,3,5-6,9-10,15H2,1-2H3
InChIKeyFACMZOKWJRUYHB-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.74
Rot. Bonds4

About 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide

2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide (PubChem CID 106594093) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
PubChem CID106594093
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCCC(N(C)S(=O)(=O)c2cccnc2CN)C1
InChIInChI=1S/C14H23N3O2S/c1-11-5-3-6-12(9-11)17(2)20(18,19)14-7-4-8-16-13(14)10-15/h4,7-8,11-12H,3,5-6,9-10,15H2,1-2H3
InChIKeyFACMZOKWJRUYHB-UHFFFAOYSA-N
XLogP1.74
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
CID 106594079
2-(aminomethyl)-N-methyl-N-(oxan-4-yl)pyridine-3-sulfonamide
CID 106593986
3-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)benzenesulfonamide
CID 61446778
2-(aminomethyl)-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-sulfonamide
CID 106594076
2-(aminomethyl)-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-3-sulfonamide
CID 106594462
2-amino-N,4,5-trimethyl-N-(3-methylcyclohexyl)benzenesulfonamide
CID 61444342
3-[cyclobutyl(methyl)sulfamoyl]pyridine-2-carbothioamide
CID 106597902
2-(aminomethyl)-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylpyridine-3-sulfonamide
CID 106594895
2-(aminomethyl)-N-(2-methylcyclopropyl)pyridine-3-sulfonamide
CID 106594415
2-(aminomethyl)-N-methyl-N-(2-methylsulfonylethyl)pyridine-3-sulfonamide
CID 106594703
1-[2-(aminomethyl)phenyl]-N-methyl-N-(3-methylcyclohexyl)methanesulfonamide
CID 61446862
2-(aminomethyl)-N-methyl-N-(3-methylbutyl)pyridine-3-sulfonamide
CID 106594065

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide (CID 106594093) is 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide is CC1CCCC(N(C)S(=O)(=O)c2cccnc2CN)C1.
What is the InChIKey of 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
The InChIKey is FACMZOKWJRUYHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-11-5-3-6-12(9-11)17(2)20(18,19)14-7-4-8-16-13(14)10-15/h4,7-8,11-12H,3,5-6,9-10,15H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide?
2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 106594093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).