2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide

C14H23N3O2S — CID 106594079

IUPAC2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCC(N(C)S(=O)(=O)c2cccnc2CN)CC1
InChIInChI=1S/C14H23N3O2S/c1-11-5-7-12(8-6-11)17(2)20(18,19)14-4-3-9-16-13(14)10-15/h3-4,9,11-12H,5-8,10,15H2,1-2H3
InChIKeyDRTWBNGDPYXUNT-UHFFFAOYSA-N
MW297.42 g/mol
LogP1.74
Rot. Bonds4

About 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide

2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide (PubChem CID 106594079) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
PubChem CID106594079
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC Name2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide
SMILESCC1CCC(N(C)S(=O)(=O)c2cccnc2CN)CC1
InChIInChI=1S/C14H23N3O2S/c1-11-5-7-12(8-6-11)17(2)20(18,19)14-4-3-9-16-13(14)10-15/h3-4,9,11-12H,5-8,10,15H2,1-2H3
InChIKeyDRTWBNGDPYXUNT-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

Analyze 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(aminomethyl)-N-methyl-N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 106594093
2-(aminomethyl)-N-methyl-N-(oxan-4-yl)pyridine-3-sulfonamide
CID 106593986
2-(aminomethyl)-N-[2-[cyclopropyl(methyl)amino]ethyl]pyridine-3-sulfonamide
CID 106594462
2-(aminomethyl)-N,N-dibutylpyridine-3-sulfonamide
CID 106593797
2-(aminomethyl)-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylpyridine-3-sulfonamide
CID 106594895
2-(aminomethyl)-N-methyl-N-(2-methylsulfonylethyl)pyridine-3-sulfonamide
CID 106594703
2-(aminomethyl)-N-methyl-N-(oxan-2-ylmethyl)pyridine-3-sulfonamide
CID 106594076
2-cyano-N-cyclopropyl-N-methylpyridine-3-sulfonamide
CID 106545449
2-(aminomethyl)-N-methyl-N-(3-methylbutyl)pyridine-3-sulfonamide
CID 106594065
(3-ethylsulfonyl-2-pyridinyl)methanamine
CID 146050328
3-[cyclobutyl(methyl)sulfamoyl]pyridine-2-carbothioamide
CID 106597902
4-(aminomethyl)-2-fluoro-N-methyl-N-(4-methylcyclohexyl)benzenesulfonamide
CID 79179448

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide?
The IUPAC name of 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide (CID 106594079) is 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide is CC1CCC(N(C)S(=O)(=O)c2cccnc2CN)CC1.
What is the InChIKey of 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide?
The InChIKey is DRTWBNGDPYXUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-11-5-7-12(8-6-11)17(2)20(18,19)14-4-3-9-16-13(14)10-15/h3-4,9,11-12H,5-8,10,15H2,1-2H3.
What are the key properties of 2-(aminomethyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-3-sulfonamide?
2-(aminomethyl)-N-methyl-N-(4-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-(4-methylcyclohexyl)pyridine-3-sulfonamide is sourced from PubChem (CID 106594079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).