N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide

C12H19N3O3S — CID 55063851

IUPACN-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NC1CCCCC1O
InChIInChI=1S/C12H19N3O3S/c1-13-12-11(7-4-8-14-12)19(17,18)15-9-5-2-3-6-10(9)16/h4,7-10,15-16H,2-3,5-6H2,1H3,(H,13,14)
InChIKeyPVKDEUHGBUZBTF-UHFFFAOYSA-N
MW285.37 g/mol
LogP0.71
Rot. Bonds4

About N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide

N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide (PubChem CID 55063851) has the molecular formula C12H19N3O3S and a molecular weight of 285.37 g/mol. Its IUPAC name is N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide
PubChem CID55063851
Molecular FormulaC12H19N3O3S
Molecular Weight285.37 g/mol
Exact Mass285.11
IUPAC NameN-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCNc1ncccc1S(=O)(=O)NC1CCCCC1O
InChIInChI=1S/C12H19N3O3S/c1-13-12-11(7-4-8-14-12)19(17,18)15-9-5-2-3-6-10(9)16/h4,7-10,15-16H,2-3,5-6H2,1H3,(H,13,14)
InChIKeyPVKDEUHGBUZBTF-UHFFFAOYSA-N
XLogP0.71
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 50.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-(2-hydroxycyclohexyl)-2-(methylamino)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

N-(2-hydroxycyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103305739
N-(cyclopentylmethyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62145518
2-(methylamino)-N-(oxan-3-yl)pyridine-3-sulfonamide
CID 63361997
N-(1,1-dioxothian-3-yl)-2-(methylamino)pyridine-3-sulfonamide
CID 63922804
N-(2-ethylcyclohexyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61468220
2-(methylamino)pyridine-3-sulfonic acid
CID 15595252
N-[(1R,2R)-2-hydroxycyclohexyl]naphthalene-1-sulfonamide
CID 104922343
N-(1-cyclopropylbutan-2-yl)-2-(methylamino)pyridine-3-sulfonamide
CID 63995591
N-[(1S,2S)-2-hydroxycyclohexyl]-2-(trifluoromethyl)benzenesulfonamide
CID 104953174
N-cyclopropyl-2-[[2-(methylamino)-3-pyridinyl]sulfonylamino]acetamide
CID 62146294
2-(ethylamino)-N-(2-methylcyclopropyl)pyridine-3-sulfonamide
CID 62410181
N-[(1S,2S)-2-hydroxycyclohexyl]-2-nitrobenzenesulfonamide
CID 101369255

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide (CID 55063851) is N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide is CNc1ncccc1S(=O)(=O)NC1CCCCC1O.
What is the InChIKey of N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide?
The InChIKey is PVKDEUHGBUZBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3S/c1-13-12-11(7-4-8-14-12)19(17,18)15-9-5-2-3-6-10(9)16/h4,7-10,15-16H,2-3,5-6H2,1H3,(H,13,14).
What are the key properties of N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide?
N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide has a molecular weight of 285.37 g/mol, XLogP of 0.71, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclohexyl)-2-(methylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 55063851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).