2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide

C13H21N3O2S — CID 62151896

IUPAC2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide
SMILESCN(CC1CCCCC1)S(=O)(=O)c1cccnc1N
InChIInChI=1S/C13H21N3O2S/c1-16(10-11-6-3-2-4-7-11)19(17,18)12-8-5-9-15-13(12)14/h5,8-9,11H,2-4,6-7,10H2,1H3,(H2,14,15)
InChIKeyKPYMAPOXDKUPJG-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.86
Rot. Bonds4

About 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide

2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide (PubChem CID 62151896) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide
PubChem CID62151896
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC Name2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide
SMILESCN(CC1CCCCC1)S(=O)(=O)c1cccnc1N
InChIInChI=1S/C13H21N3O2S/c1-16(10-11-6-3-2-4-7-11)19(17,18)12-8-5-9-15-13(12)14/h5,8-9,11H,2-4,6-7,10H2,1H3,(H2,14,15)
InChIKeyKPYMAPOXDKUPJG-UHFFFAOYSA-N
XLogP1.86
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]pyridine-3-sulfonamide
CID 63234934
2-amino-N-(cyclohexylmethyl)-N-cyclopropylpyridine-3-sulfonamide
CID 65427611
3-[cyclobutylmethyl(methyl)sulfamoyl]pyridine-2-carbothioamide
CID 106597236
2-amino-N-methyl-N-(2,2,2-trifluoroethyl)pyridine-3-sulfonamide
CID 62146162
2-amino-N-cyclopentyl-N-[2-(dimethylamino)ethyl]pyridine-3-sulfonamide
CID 65427997
3-N-(cyclohexylmethyl)-3-N-methylpyridine-2,3-diamine
CID 104540064
N-(cyclopentylmethyl)-2-hydrazinyl-N-methylbenzenesulfonamide
CID 63656151
3-[4-[(dimethylamino)methyl]piperidin-1-yl]sulfonylpyridin-2-amine
CID 62156935
2-amino-N-(2-hydroxy-2-methylpropyl)-N-methylpyridine-3-sulfonamide
CID 79381363
N-(cyclopropylmethyl)-N-methyl-2-(propylamino)pyridine-3-sulfonamide
CID 62146200
3-[methyl(oxan-4-ylmethyl)sulfamoyl]pyridine-2-carbothioamide
CID 106597356
2-[(2-amino-3-pyridinyl)sulfonyl-methylamino]-N,N-dimethylacetamide
CID 65427602

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide (CID 62151896) is 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide is CN(CC1CCCCC1)S(=O)(=O)c1cccnc1N.
What is the InChIKey of 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide?
The InChIKey is KPYMAPOXDKUPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-16(10-11-6-3-2-4-7-11)19(17,18)12-8-5-9-15-13(12)14/h5,8-9,11H,2-4,6-7,10H2,1H3,(H2,14,15).
What are the key properties of 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide?
2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(cyclohexylmethyl)-N-methylpyridine-3-sulfonamide is sourced from PubChem (CID 62151896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).